XXV General Assembly and Congress of the
International Union of Crystallography - IUCr 2021

August 14 - 22, 2021 | Prague, Czech Republic

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Index of Authors

A list of all persons who contribute to the sessions of this conference. Please select a letter below to list all persons with the corresponding surname. Select the presentation in the right-hand column to access session and presentation details.

List by Initial Letter: A B C D E F G H I J K L M N O P Q R S T U V W X Y Z Á Ö Ø Č Đ İ Ł Ř Ś Š Ž

List Options: Authors and Sessions · Authors and Sessions (Short Titles) · Authors and Presentations

Author(s)	Organization(s)	Contribution Title
S. Chang, Boyce	Department of Materials Science and Engineering, Iowa State University, Ames, IA 50011 USA; US DOE Ames Laboratory, Ames, Iowa, 50011, USA	NMR assisted structure determination of coordination polymers
S. M. Abdelbaky, Mohammed	Departments of Physical and Analytical Chemistry, and Organic and Inorganic Chemistry University of Oviedo-CINN, 33006 Oviedo	Impact of Co²⁺ substitution on microstructural evolution and magnetic properties of zinc ferrite nanoparticles synthesized by precipitation and hydrothermal-joint method Presenter
S. Sen, Sakya	CSIR-NATIONAL CHEMICAL LABORATORY, Pune, India	Reactivity, bonding and structural elucidation of pendant methyl-pyridinato β-diketiminate ligand moiety
S. Weiss, Manfred	Helmholtz-Zentrum Berlin, Macromolecular Crystallography, Albert-Einstein-Str. 15, 12489 Berlin, Germany	Hundreds of starting points for spliceosomal PPI modulators identified by crystallographic fragment screening with the F2X-Universal Library
Saadi, Mohamed	University Mohammed V Faculty of sciences Rabat, RABAT, Morocco	Crystal structure of lead dinickel iron tris(orthophosphate): PbNi₂Fe(PO₄)₃
Sacerdoti, Mariana	IBioBA - CONICET - Partner Institute of the Max Planck Society, Buenos Aires, Argentine Republic	Chemical biology and structural studies on the mechanism of regulation of phosphoinositide-dependent protein kinase 1 (PDK1)
Sacharz, Joanna	University of Melbourne, Melbourne, Australia	Unravelling the molecular architecture of the Commander assembly
Sadki, Mustapha	Malvern Panalytical B.V., Almelo, Netherlands, The	Easy Automation & More Accurate Analysis with HighScore(Plus) V4.
Saeed, Zeinab M.	Khalifa University of Science and Technology, Abu Dhabi, United Arab Emirates	Expanding the crystal form landscape: emerging computational tools for the discovery of eutectic composites and higher-order cocrystals of organic compounds
Saez-Ferre, S.	Instituto de Tecnología Química (UPV-CSIC) Universitat Politècnica de València-Consejo Superior de Investigaciones Científicas, Valencia, SPAIN	Use of alkylarsonium cations as probe molecules for the study of zeolites
Sagarika, Dev	MCM DAV College for Women, Sector 36, Chandigarh, Union Territory, India. 160036	Pharmaceutical cocrystallization: polymorphs, salts and cocrystals
Sagmeister, Theo	Institute of Molecular Biosciences, University of Graz, Austria	Surface Layer Proteins of Lactobacillus acidophilus - A Story of SlpA and SlpX Presenter
Saha, Debdulal	CSIR Central Glass and Ceramic Research Institute, KOLKATA, India	Understanding the gas sensing mechanism in vanadium doped tin oxides using X-ray diffraction and X-ray photoelectron spectroscopy
Sahoo, Sibasis	International Centre for Genetic Engineering and Biotechnology, New Delhi, India	Structure guided inhibitor discovery targeting a membrane receptor involved in atherosclerosis
SAIJO, Shinya	High Energy Accelerator Research Organization (KEK)	Crystal structure of atypical ubiquitin ligase PCAF_N
Saines, Paul J.	School of Physical Sciences, University of Kent, Canterbury, Kent, United Kingdom	Enhancing the Chemical Flexibility of Hybrid Perovskites by Introducing Divalent Ligands Presenter Exploring the magnetocaloric effect in the Ln(HCO₂)(C₂O₄) family of Metal-Organic Frameworks Geometric frustration on the trillium lattice in a magnetic metal–organic framework
Saio, Tomohide	Institute of Advanced Medical Sciences, Tokushima University, Tokushima, Japan	Application of a lanthanide tag for evaluation of conformational states of a multidomain protein Presenter
Saito, Keisuke	Rigaku Americas Corp., The Woodlands, TX, USA	Using Zoom Webinar to Teach Advanced Topics in Crystallography
Saito, Takashi	Institute of Materials Structure Science, KEK, JP	Complex A-site magnetism in quadruple perovskite materials
Sajieddine, Mohammed	Material Physics Laboratory, Faculty of Sciences and Techniques, Sultan Moulay Sliman University, B.P. 523, 23000 Beni–Mellal, Morocco	Structural, magnetic and optical properties study of tellurium–based: Sr_3–xPb_xFe₂TeO₉ (0 ≤ x ≤ 2.25) double perovskites
Sakai, Hideaki	Department of Physics, Osaka University, Toyonaka, Japan; PRESTO, Japan Science and Technology Agency, Kawaguchi, Japan	Suppression mechanism of the ferroelectric polarization in multiferroic tetragonal perovskiteSr_1/2Ba_1/2MnO₃
SAKAI, Mashito	National Center for Global Health and Medicine	Crystal structure of atypical ubiquitin ligase PCAF_N
Sakakibara, Futa	3Sigma-Aldrich Japan, Tokyo, Japan	Application of the Crystalline Sponge Method for Structure Determination of Persistent Organic Pollutants of Agrochemical Degradation Products
Sakamaki, Yusuke	Kyoto University, Osaka, Japan	Subunit dynamics in alpha-crystallin through deuteration-assisted small-angle neutron scattering
Sakamoto, Hiroshi	Kyushu Institute of Technology, Iizuka, Japan	Domain movements of NADPH–cytochrome P450 oxidoreductase (CPR) are required for the smooth electron transfer from CPR to heme–heme oxygenase-1 (HO-1) complex
Sakly, Nahed	CRISMAT, CNRS-ENSICAEN,6 Bd du Maréchal Juin, 14050 Caen Cedex, France	Designing Composite Spin Chain Structures Built up of Dimeric and Trimeric Polyhedral Units: The oxides A_1+y[(Mn_1-xCo_x)_1-z◊_z]O₃ (A=Ca, Sr; x = 3/8).
Sakurai, Hiroshi	Gunma University, Kiryu, Japan	Redox oscillations in 18650-type lithium-ion cell revealed by in-operando Compton scattering imaging
Sakurai, Naofumi	Faculty of Advanced Life Science, Hokkaido university	Structural insights into the phlorotannin binding of EHEP and akuBGL for producing biofuel from brown algae
Sakurai, Yoshiharu	Japan Synchrotron Radiation Research Institute, SPring-8, Sayo, Japan	Redox oscillations in 18650-type lithium-ion cell revealed by in-operando Compton scattering imaging
Sala, G.	Oak Ridge National Laboratory, Oak Ridge, United States of America	IInvestigating the nature of the magnetoelectric coupling in molecular (ND₄)₂[FeCl₅(D₂O)] via neutron scattering studies
Salani, Gian Marco	Department of Physics and Earth Sciences, University of Ferrara, Via Saragat 1, I-44121, Ferrara, Italy.	Adsorption and degradation mechanisms of perfluoroalkyl substances (PFAS) on Ag-exchanged FAU-type zeolite studied by in situ synchrotron X-ray diffraction and thermal analysis/isotope ratio mass spectrometry.
Salditt, Tim	Georg-August-Universitaet Goettingen, Goettingen, Germany	Super-resolution X-ray holography
Sale, Matthew	The University of Sydney, Sydney, Australia	Stoichiometric molecular hydration of interstitial sites in a close-packed ionic lattice
Sali, Andrej	University of California, San Francisco, San Francisco, United States of America	From integrative structural biology to cell biology
Salnikov, Andrii	MAX IV Laboratory, Lund University, Sweden	Azimuthal integration and crystallographic algorithms on field-programmable gate arrays
Salome, Murielle	European Synchrotron Radiation Facility, 71 Avenue des Martyrs, Grenoble, France	Coherent X-ray imaging at ID16A: status and plans
Samara, Yasmin	Universidade Federal de Santa Maria, 97105-900 Santa Maria-RS	Using sound pulses to solve the crystal harvesting bottleneck
Samoľová, Erika	Department of Structure Analysis, Institute of Physics, Czech Academy of Sciences, Prague, Czech Republic; Institute of Physics of the Czech Academy of Sciences, Na Slovance 2, 182 21 Prague, Czech Republic	Crystallochemistry of Ni(II) complexes based on halogen derivatives of 8-hydroxyquinoline with different bridging of central atoms Zinc complexes with nitroderivatives of quinolin-8-ol
Samolová, Erika	Institute of Physics of the Czech Academy of Sciences, Praha 8, Czech Republic	Crystallographic Aspects of the Propanoate Salts
Samothrakitis, Stavros	Paul-Scherrer Institute, Switzerland	Trindex - 3D Grain Orientation Mapping with Neutron Imaging
Samperisi, Laura	stockholm university, stockholm, Sweden	Elucidation of Linker Motion in Metal-Organic Frameworks by Three-Dimensional Electron Diffraction Presenter
San Martin, Fabiana	Lab of Molecular & Structural Microbiology, Institut Pasteur de Montevideo, Mataojo 2020, Montevideo, Uruguay	An asymmetric structure of the filament is key to inducing flagellar curvature and enabling motility in the Leptospira spirochete
Sánchez, Rodolfo D.	Instituto de Nanociencia y Nanotecnología CNEA-CONICET, Centro Atómico Bariloche, Av. Bustillo 9500 R8402AGP, S. C. de Bariloche, Argentina; Instituto Balseiro, Universidad Nacional de Cuyo - Comisión Nacional de Energía Atómica, Av. Bustillo 9500 R8402AGP, S. C. de Bariloche, Argentina	Novel incommensurate magnetic phase in the magnetoelectric Sr-doped cobaltate CaBaCo₄O₇
Sanchez, Sophie	Uppsala University, Department of Organismal Biology, Evolutionary Biology Centre, Norbyvägen 18 A, 75236, Uppsala, Sweden.	Non-destructive 3D orientational mapping of bone using diffractive X-ray tomography
Sánchez Andújar, Manuel	Department of Chemistry, Universidade da Coruna, Spain	Crystal and Magnetic structures and Dielectric phase transition of the novel Organic-Inorganic Hybrid Halometallate compound: (quinuclidine)[FeCl₄]
Sanchez Rodriguez, Filomeno	University of Liverpool, Liverpool, United Kingdom; Life Science, Diamond Light Source, Harwell Science and Innovation Campus, Didcot, Oxfordshire, United Kingdom	Applications of residue contact predictions in structural biology. Presenter ConPlot: web-based tool for the visualization of protein contact maps and distograms integrated with other data
Sanchez-Benitez, Javier		Introduction to session Presenter
Sanchez-Garcia, Ruben	Spanish National Bioinformatics Institute (INB ELIXIR-ES). Biocomputing Unit, National Center for Biotechnology (CNB-CSIC). Instruct Image Processing Center	3DBionotes Covid-19 Edition
Sandemann, Jonas Ruby	Department of Chemistry & Interdisplinary Nanoscience Center (iNANO), Aarhus University, Denmark	Crystal growth and structural studies of spinel ferrites Presenter
Šanderová, Hana	Institute of Microbiology of the Czech Academy of Sciences, Prague, Czech Republic	Deciphering the role of unique bacterial transcription-associated factor HelD.
Sanderson, James	Newcastle University, Newcastle upon Tyne, United Kingdom	FragLites: a library of small molecules incorporating anomalous scatterers with applications in screening and protein interaction mapping
Sangregorio, Claudio	Istituto di Chimica dei Composti OrganoMetallici - Consiglio Nazionale delle Ricerche (ICCOM-CNR), Via Madonna del Piano 10, 50019 Sesto Fiorentino (FI), Italy	Spinel ferrite nanoparticles in core shell architecture for heat release
Sanna Angotzi, Marco	University of Cagliari, Cagliari, Italy	Spinel ferrite nanoparticles in core shell architecture for heat release
Sanna Angotzi, Marco	University of Cagliari, Monserrato (CA), Italy	From CO₂ to dimethyl ether: mesostructured acidic oxides for methanol dehydration to design bifunctional catalysts
Sanna Angotzi, Marco	Department of Chemical and Geological Sciences, University of Cagliari, S.S. 554 bivio per Sestu, 09042 Monserrato (CA), Italy	Spinel ferrite nanoparticles in core shell architecture for heat release Presenter
Sans, Juan Angel	Instituto de Diseño para la Fabricación, Universitat Politècnica de València, Valencia, Spain	Phase transitions and magnetic structures in Epsilon-Fe₂O₃ nanoparticles
Sans, Juan Ángel	Universitat Politècnica de València, Spain	Unveiling the structural and electronic interplay in 3d and 4f/5d compounds at high-pressure
Sant´Anna, Osvaldo Augusto Brazil Esteves	Imunochemistry Laboratory, Butantan Institute, São Paulo - SP, Brazil	Using crystallography tools to improve vaccine formulations
Sant'Anna Junior, Almiro	Department of Mining Engineering, School of Mines, Federal University of Ouro Preto – UFOP, Ouro Preto, MG, Brazil	New insights about chemical etching for revelation of spontaneous fission tracks in garnets
Santacruz, Isabel	Universidad de Malaga, Malaga, Spain	Characterization of C-S-H gels by pair distribution function analysis
Santana, João Pedro de J.	Department of Geology, Federal University of Rio Grande do Sul – UFRGS.	New insights about chemical etching for revelation of spontaneous fission tracks in garnets
Santini, Joanne M	Institute of Structural and Molecular Biology, Division of Biosciences, University College London, London WC1E 6BT, United Kingdom	Crystal structure of a complex between the electron-transfer partners arsenite oxidase and cytochrome c552, from the arsenite respiring bacterium Rhizobium sp. NT-26.
Santiso-Quinones, Gustavo	ELDICO Scientific AG, 5234 Villigen, Switzerland	3D Electron diffraction for the discovery of new crystal forms of APIs 3D electron diffraction: a dedicated device for structural elucidation of nanocrystalline particles Presenter An electron diffractometer : A novel device for electron crystallography experiments The ´Why´ and ´How´ of a Dedicated Electron Diffractometer The Future of Co-crystallisation: A New Workflow Based on AI Predictions, the Crystal16 Platform and Electron Diffraction
Santner, Heiner	Anton Paar GmbH, Graz, Austria	Operando SAXS/WAXS studies for structure determination of energy storage materials using a unique electrochemical-scattering cell
Santoni, Gianluca		Introduction to session Presenter
Santos-Hurtado, Carina	Institute of Organic Chemistry and Biochemistry AS CR, Prague, Czech Republic	NMR crystallography of 2D and 3D assemblies of functional molecules
Sanyal, Ambarish	CSIR Central Glass and Ceramic Research Institute, KOLKATA, India	Understanding the gas sensing mechanism in vanadium doped tin oxides using X-ray diffraction and X-ray photoelectron spectroscopy
Saouane, Sofiane	Photon Science, Deutsches Elektronen-Synchrotron DESY, Hamburg, Germany	Serial and Macromolecular Crystallography at beamline P11, Petra III
Sapchenko, Sergei Alexandrovich		Introduction to session Presenter
Sarkar, Sounak	Center for Materials Crystallography, Department of Chemistry and iNano, Aarhus University, Aarhus 8000, Denmark	Thermal stability of Glass forming Metal-Organic Framework: Role of metal-ligand bonding Presenter
Sarott, Martin	Department of Materials Science, ETH Zurich, Zurich, Switzerland	Studying local order in ferroelectric oxide superlattices with three-dimensional diffuse X-ray scattering
Šaroun, Jan	Nuclear Physics Institute ASCR, v.v.i., Řež, Czech Republic	High-resolution neutron three axis diffractometer for studies of elastic and plastic deformation of polycrystalline materials
Sarr, Mamour	Université Cheikh Anta DIOP de Dakar, Dakar, Senegal	Co-crystal structure of a dinuclear (Zn-Y) and a trinuclear (Zn-Y-Zn) complexes derived from a Schiff base ligand
Sashuk, Volodymyr	Institute of Physical Chemistry Polish Academy of Sciences, Warsaw, Poland	Electrostatic self-assembly of organic crystals from charged macrocycles How guest molecules affect on the self-assembly of carboxylated pillar[5]arene in its complexes
Sato, Hideaki	Kurume University School of Medicine, Kurume, Japan	Domain movements of NADPH–cytochrome P450 oxidoreductase (CPR) are required for the smooth electron transfer from CPR to heme–heme oxygenase-1 (HO-1) complex
Sato, Hiroyasu	Rigaku Corporation, 3-9-12 Matasubara-cho, Akishima-shi, Tokyo 196-8666, Japan	Photothermal high-speed crystal actuation and the simulation
Sato, Hiroyasu	Rigaku Corporation, Tokyo, Japan	Applications of X-ray diffraction for microcrystalline sample using the latest single crystal laboratory systems. Presenter Synergy ED: A new electron diffractometer for microED
Sato, Nobuhiro	Institute for Integrated Radiation and Nuclear Science, Kyoto University, Osaka, Japan	Structural analysis of antibody complexes by inverse contrast-matching small-angle neutron scattering combined with size exclusion chromatography (SEC-iCM-SANS) AUC-SAS: Integrated analysis of biomacromolecular structure with analytical ultracentrifugation (AUC) and small-angle scattering (SAS) Dynamics of multi-domain protein ER-60 revealed by small angle X-ray scattering data and molecular dynamics simulations Establishment of basic techniques related to protein sample preparation for neutron scattering Subunit dynamics in alpha-crystallin through deuteration-assisted small-angle neutron scattering
Sato, Ryota	Institute for Chemical Research, Kyoto University, Kyoto 611-0011, Japan	Picometer-level core-shell structure in Pd nanocrystals revealed by total scattering
SATO, Sota	Department of Applied Chemistry, The University of Tokyo, Tokyo, Japan	Functional crystalline materials based on macrocyclic nanochannels Preferences of Chirality and Polarity in Triglycine sulfate Crystals Preferences of Chirality and Polarity in Triglycine sulfate Crystals
Sato, Takashi	Rigaku Corporation, Tokyo, Japan	Application of the Crystalline Sponge Method for Structure Determination of Persistent Organic Pollutants of Agrochemical Degradation Products
Sato, Taku J	IMRAM, Tohoku University, Sendai, Japan	Magnetic properties and magnetic structure of the quasi one-dimensional antiferromagnet Cu₂(MoO₄)(SeO₃) Suppression mechanism of the ferroelectric polarization in multiferroic tetragonal perovskiteSr_1/2Ba_1/2MnO₃
Saura-Muzquiz, Matilde	School of Chemistry, University of Sydney, Sydney, NSW 2006, Australia	Cation order and magnetic behaviour in mixed metal bismuth scheelite Bi₃FeMo₂O₁₂ Presenter
Sauter, Claude	Université de Strasbourg, ARN, CNRS UPR9002, IBMC, Strasbourg, France	Monitoring the crystallization of two enzymes in real time by dynamic light-scattering
Savasci, Gökcen	Max Planck Institute for Solid State Research, Stuttgart, Germany; Department of Chemistry, Ludwig- Maximilians-Universität (LMU), Munich, Germany; Exzellenzcluster E-conversion, Garching, Germany and Center for NanoScience, Munich, Germany	Developing more precise structural descriptions of layered covalent organic frameworks using total scattering data
Savchenkov, Anton V.	Samara National Research University, Samara, Russian Federation	The phenomenon of polymorphism within the stereoatomic model of crystal structures Presenter
Saverwyns, Steven	Laboratory Department, Royal Institute for Cultural Heritage, Brussels, Belgium	Macroscopic X-ray powder diffraction imaging for the study of oil paintings
Savvides, Savvas		Introduction to session Presenter
Savvin, Stanislav N.	Institut Laue-Lengevin, France; Diffraction group, Institut Laue-Langevin (ILL) Grenoble, France	Revisiting the crystal structure and magneto-elastic coupling in MnZnSb Structural phase transition and magnetic phase diagram of the lacunar spinel GaMo₄Se₈
Sawada, Jun-ichi	Center for Drug Discovery, Graduate School of Pharmaceutical Sciences, University of Shizuoka	Structure determination of the motor domain of centromere associated protein E
SAWADOGO, Moustapha	Université Joseph KI ZERBO, Ouagadougou, Burkina Faso; University Joseph Ki-Zerbo, Ouagadougou, Burkina Faso	Formulation of clay refractory bricks: influence of the nature of chamotte and the alumina content in the clay Presenter Geopolymers based on some clay from Burkina Faso : preparation and characterization
SAWADOGO, Youssouf	University Joseph Ki-Zerbo, Ouagadougou, Burkina Faso	Geopolymers based on some clay from Burkina Faso : preparation and characterization
Sawasaki, Tatsuya	Proteo-Science Center, Ehime University	Structural insight into the degradation selectivity of C2H2 zinc finger by thalidomide metabolite
Sawaya, Michael R.	UCLA-DOE Institute for Genomics and Proteomics, Los Angeles, CA 90095, USA.	Different methods for phasing diffraction data – macromolecules
Saxena, Avadh B		Introduction to session Presenter
Saxena, Siddharth	University of Cambridge, United Kingdom (Gb), United Kingdom	Evolution of Structural, Magnetic and Electronic Properties with Pressure in TMPX₃ van-der-Waals Compounds
Scammells, Peter	Medicinal Chemistry, Monash Institute of Pharmaceutical Sciences, Monash University, Parkville, VIC, 3052, Australia	Fragment-based development of bacterial DsbA inhibitors as novel anti-virulence agents
Scanlon, Martin	Medicinal Chemistry, Monash Institute of Pharmaceutical Sciences, Monash University, Parkville, VIC, 3052, Australia	Fragment-based development of bacterial DsbA inhibitors as novel anti-virulence agents
Scarpelli, Francesca	Università della Calabria, Arcavacata di Rende , Italy	Polymorphism and structural characterization of a Silver(I) coordination polymer: an inorganic-polymer co-former in the preparation of curcumin containing co-crystals Presenter
Scatena, Rebecca	University of Oxford, Oxford, United Kingdom; University College London, London, United Kingdom	Formate-mediated Magnetic Superexchange in the Model Hybrid Perovskite [(CH₃)₂NH₂]Cu(HCOO)₃: Applicability criteria for the GKA rules Presenter
Scelta, Demetrio	LENS - European Laboratory for Non-Linear Spectroscopy, Sesto Fiorentino, Italy; ICCOM-CNR, National Research Council of Italy, Sesto Fiorentino, Italy	Phase diagram of carbon dioxide revisited
Schaefer, Andreas	The Francis Crick Institute, London, United Kingdom	Imaging of synapses in 3D with non-destructive synchrotron X-ray ptychography
Schäfer, Christian	MPI für Kohlenforschung, Mülheim an der Ruhr, Germany	The Chemical Crystallography Beamline P24 - Status and Future Developments
Schallenberg-Rüdinger, Mareike	IZMB – Institut für Zelluläre und Molekulare Botanik, Abt. Molekulare Evolution, University of Bonn, Bonn, Germany	Structures of a DYW domain shed first light on a unique plant RNA editing regulation principle
Schaller, Achim Mathias	University of Bayreuth, Laboratory of Crystallography, Bayreuth, Germany; Laboratory of Crystallography, University of Bayreuth, 95447 Bayreuth, Germany	High-pressure low-temperature phase transitions and structural development in quasi-two-dimensional transition metal oxychlorides Presenter Temperature dependent structural studies of incommensurately modulated Rb₂ZnCl₄
Schaniel, Dominik	CRM2, Jean Barriol Institute, CNRS UMR 7036, University of Lorraine, BP 70239, Boulevard des Aiguillettes, 54506 Vandoeuvre-lès-Nancy, France; Universite de Lorraine & CNRS, Vandoeuvre-les-Nancy,France	Light- and temperature-induced linkage isomerism in a series of Ni^II, Cu^II and Co^III complexes in the solid state Photocrystallographic studies of novel nickel (II) nitro complex supplemented by IR spectroscopy and multi-temperature XRD experiments
Scheffzük, Christian	Joint Institute for Nuclear Research, Frank Laboratory of Neutron Physics, Joliot-Curie 6, Dubna 141980, Russia	Mechanisms of elastic-plastic deformation in magnesium alloy studied using neutron diffraction and crystallite group method
Scheinost, Andreas C.	The Rossendorf Beamline at the European Synchrotron Radiation Facility (ESRF), Avenue des Martyrs 71, 38043 Grenoble, France; Helmholtz Zentrum Dresden Rossendorf, Institute of Resource Ecology, Bautzner Landstrasse 400, 01328, Dresden, Germany	Combining X-ray diffraction, X-ray absorption spectroscopy, and molecular dynamics simulations to probe metals in zeolites: the case of intergrown Cd²⁺-LEV/ERI
Schembri, Mark	Australian Infectious Diseases Research Centre, School of Chemistry and Molecular Biosciences, The University of Queensland, Brisbane, Queensland, Australia	Uncovering the structures and mechanisms for the largest group of bacterial surface virulence factors.
Schiebel, Ralf	Department of Climate Geochemistry, Max Planck Institute for Chemistry, Hahn-Meitner-Weg 1, 55128 Mainz, Germany	Rietveld and pair-distribution function analysis of nanogranular mesocrystalline shells of hyaline foraminifers
Schindelin, Hermann	University of Wuerzburg, Wuerzburg, Germany	Investigating the redox cycle of tryparedoxin at ultra-high resolution Presenter
Schleid, Thomas	University of Stuttgart, Stuttgart, Germany	HoF(OH)₂: A fluoride-containing holmium(III) hydroxide with UCl₃-type crystal structure Presenter Pr_1.333[P₂Se₆]: A link between two non-isotypic relatives Synthesis, phase characterization and crystal structure comparison of a self-made SmF₂–SmFCl–SmFO mixture by XRD and EDX
Schlesinger, Carina	Goethe Universitaet, Frankfurt am Main, Germany	Wrong organic crystal structures solved and refined from powder data
Schlichting, Ilme	MPI, Heidelberg, Germany	High-resolution structure and reaction cycle of Fatty Acid Photodecarboxylase: anatomy of a crime scene
Schmid, Chiara	Department of Engineering and Architecture, University of Trieste, Trieste, Italy	A multidisciplinary study unveils the nature of a Roman ink of the I century AD
Schmid, Michael	Stanford University, SLAC National Accelerator Laboratory	Quantifiying resolvability of atomic features in cryo-EM maps using Q-scores
Schmid, Siegbert		Introduction to session Presenter
Schmidt, Ella Mara	Inorganic Chemistry, University of Oxford, United Kingdom; University of Oxford, Oxford, United Kingdom	3D-ΔPDF from electron diffraction data Presenter Mean field theory calculations to model single crystal diffuse scattering Presenter
Schmidt, Martin U.		Introduction to session Presenter
Schmidt, Martin U.	Institute of Inorganic and Analytical Chemistry, Goethe University Frankfurt, Max-von-Laue-Str. 7, 60438 Frankfurt a.M., Germany; Goethe Universitaet, Frankfurt am Main, Germany	Rietveld and pair-distribution function analysis of nanogranular mesocrystalline shells of hyaline foraminifers Wrong organic crystal structures solved and refined from powder data Presenter
Schmidt, Soren	European Spallation Source ERIC, Sweden	Trindex - 3D Grain Orientation Mapping with Neutron Imaging
Schmidt, Wolfgang	Max-Planck-Institut für Kohlenforschung, Heterogeneous Catalysis, Kaiser-Wilhelm-Platz 1, 45470 Mülheim an der Ruhr, Germany	In situ XRPD of the synthesis of corundum from boehmite during ball milling. Ab initio structure determination of two new titanium phosphates synthesized via molten salt synthesis.
Schneider, Bohdan	Institute of Biotechnology of the Czech Academy of Sciences, Vestec, Czech Republic	A nucleic acid structural alphabet and conformational analyses at dnatco.datmos.org Presenter
Schneider, Bohdan	Institute of Biotechnology, Vestec near Prague, Czech Republic	The first hydration layer around biomolecules is site-specific
Schneider, Bohdan	Institute of Biotechnology CAS v.v.i., Vestec, Czech Republic	Light-induced oligomerization of the transcription factor EL222
Schneidman, Dina		Introduction to session Presenter
Schneidman, Dina	The Hebrew University of Jerusalem, Jerusalem, Israel	Integrative modeling of structure and dynamics of macromolecules based on SAXS profiles and cross-linking mass spectrometry
Schoeller, Martin	Slovak University of Technology, Bratislava , Slovak Republic	Syntheses and crystal structures of new ruthenium(II) organometallic compounds with NSAID type ligands Presenter
Schoenwaelder, Christopher	SLAC National Accelerator Laboratory, Menlo Park, USA	Phase Changes in Dynamically Compressed Water
Schofield, Christopher J.	Department of Chemistry, University of Oxford, Oxford, United Kingdom	HIF-Prolyl-Hydroxylase 2 Clinical Inhibitor Complex Structure and XChem Fragment-Based Screen Obtained with Succinate Co-Product Used as a Crystallisation Tool.
Schönleber, Andreas	Laboratory of Crystallography, University of Bayreuth, D-95440 Bayreuth, Germany	Modulated molecular crystals: Incommensurate, high Zʹ forms and their variation as function of temperature and stress
Schorr, Susan	Helmholtz-Zentrum Berlin für Materialien und Energie, Berlin, Germany; Freie Universitaet Berlin, Institute of Geological Sciences, Berlin, Germany; Freie Universität Berlin, Berlin, Germany	An anomalous diffraction study of Cu₂Zn(Ge,Si)Se₄ Cation disorder in zinc-group IV- nitride and oxide nitride semiconductor materials revealed through neutron diffraction Presenter Halide Perovskites – structural systematisation and what we learn from it. Why the knowledge of the anharmonicity is important for the structural processes that govern the orthorhombic/tetragonal phase transformation in chlorine-substituted MAPbI₃ X-ray Corelab @HZB: A user lab for multi-purpose materials research
Schrader, Tobias E.	Jülich Centre for Neutron Science (JCNS) at Heinz Maier-Leibnitz Zentrum (MLZ), Garching, Germany	Macromolecular Neutron Diffraction at the Heinz Maier-Leibnitz Zentrum
Schrank, Evelyne	University of Graz, Graz, Austria	Investigations on Vibrio cholerae sensory regulator ToxR
Schreuer, Jürgen	Ruhr-Universität Bochum, Bochum, Germany	Thermoelastic instabilities in rare-earth perovskites REScO₃ (RE = Nd, Sm, Tb, Dy)
Schreyer, Martin	Malvern Panalytical B.V., Almelo, Netherlands, The	In-situ XRD and PDF investigation of battery fluoride materials MF₃.3H₂O (M = Fe, Cr) in controlled atmosphere: accessing new phases with controlled chemistry Presenter
Schrode, Benedikt	Graz Technical University, Graz, Austria	An efficient method for indexing grazing-incidence X-ray diffraction data of epitaxially grown thin films
Schrode, Benedikt	Anton Paar GmbH, Graz, Austria	Non-ambient X-ray diffraction – a further dimension in crystallography The latest X-ray analysis solutions from Anton Paar
Schröder, Gabriela C.	Department of Molecular and Structural Biochemistry, North Carolina State University, Raleigh, NC 27695, USA; Neutron Scattering Division, Oak Ridge National Laboratory, Oak Ridge, TN 37831, USA.	Toward elucidating the mechanism of lytic polysaccharide monooxygenases: Chemical insights from X-ray and neutron crystallography Presenter
Schröder, Vincent	Humboldt-Universität zu Berlin; Helmholtz-Zentrum Berlin für Materialien und Energie	Polymorphic tuning of a flexible organic crystal optical waveguide
Schroer, Christian G.	Deutsches Elektronen-Synchrotron DESY, Hamburg, Germany; Department Physik, Universität Hamburg, Hamburg, Germany	Coupled ptychography and tomography reconstruction of experimental data
Schroer, Martin	EMBL Hamburg c/o DESY, Notkestrasse 85, 22607 Hamburg, Germany	Anomalous small-angle X-ray scattering on biological macromolecules at the P12 beamline of EMBL-Hamburg
Schropp, Andreas	DESY, Notkestrasse 85, 2260 Hamburg, Germany	Simultaneous imaging and diffraction of phase transitions at intermediate compression rates
Schroth, Philipp	Karlsruhe Institute of Technology (KIT), Karlsruhe, Germany	MBE growth Monitoring of a single GaAs nanowire by in-situ X-ray nano-diffraction
Schuck, Götz	Helmholtz-Zentrum Berlin für Materialien und Energie, Berlin, Germany	An anomalous diffraction study of Cu₂Zn(Ge,Si)Se₄ Why the knowledge of the anharmonicity is important for the structural processes that govern the orthorhombic/tetragonal phase transformation in chlorine-substituted MAPbI₃ Presenter
Schulte, Alfons	University of Central Florida, Orlando FL. U.S.A.	Kinetics of mesoglobule formation and disintegration in solutions of thermoresponsive polymers after fast pressure jumps
Schulz, Beate M.	University of Stuttgart, Stuttgart, Germany	Pr_1.333[P₂Se₆]: A link between two non-isotypic relatives
Schulz, Ben	School of Chemistry and Molecular Bioscience, The University of Queensland, St Lucia, Australia	Structure, function and evolution of the orally active insecticidal toxin complex, YenTc
Schulz, Florian	University of Hamburg, Grindelallee 117, 20146 Hamburg, Germany	Anomalous small-angle X-ray scattering on biological macromolecules at the P12 beamline of EMBL-Hamburg
Schulz-Ritter, Heiko	Deutsches Elektronen-Synchrotron (DESY), Hamburg, Germany	Magnetic x-ray standing waves
Schulze, Jörg O.	Department of Internal Medicine I, Universitätsklinikum Frankfurt, Germany	Chemical biology and structural studies on the mechanism of regulation of phosphoinositide-dependent protein kinase 1 (PDK1)
Schulze-Briese, Clemens	DECTRIS, Baden-Dättwil, Switzerland	Strategy in the age of 360° sweeps
Schulze-Jonack, Isabelle	Leibniz-Institut für Kristallzüchtung, Berlin, Germany	Thermoelastic instabilities in rare-earth perovskites REScO₃ (RE = Nd, Sm, Tb, Dy)
Schurko, Robert	Department of Chemistry and Biochemistry, Florida State University, Tallahassee, FL, 32306; National High Magnetic Field Laboratory, Tallahassee, FL, 32310	A new NMR crystallographic protocol based on quadrupolar nuclei Presenter
Schürmann, Christian	Rigaku Europe SE, Frankfurt, Germany	PDF Analysis of Crystalline and Amorphous Materials on a Home Laboratory Diffractometer Using Zoom Webinar to Teach Advanced Topics in Crystallography
Schurmann, Jonathan	MAX IV Laboratory, Lund, Sweden	Automated ML-based sample centering for macromolecular X-ray crystallography with MXAimbot
Schuster, Anja	Helmholtz-Zentrum Dresden-Rossendorf, Dresden, Germany	Phase Changes in Dynamically Compressed Water
Schutte-Smith, Marietjie	University of the Free State, Bloemfontein, South Africa	Structure and Reactivity of Rhodium(I) Carbonyl complexes as Model Nano-Wired Assemblies and Catalyst Structure-activity relationship of imidazo[4,-f]1,10-phenanthroline type ligands and their Rhenium(I) complexes-photoluminescence and DNA intercalation The Manipulation Of Metal-Metal Bonding Distances By Variation Of The Size Of N-Substituents On PNP Ligand Systems
Schwaighofer, Bettina	Department of Chemistry, Durham University, Science Site, South Road, Durham DH1 3LE, U.K.; Institut Laue Langevin, 71 Rue de Martyrs, 38000 Grenoble, France	Expanded chemistry and mixed ionic-electronic conductivity in vanadium-substituted variants of γ-Ba₄Nb₂O₉
Schwarz, Nicholas	Advanced Photon Source, Argonne National Laboratory, Lemont, IL 60439, United States	Collaborative software solutions and data standards for ptychographic Imaging
Schweinle, Catherine	Institute of Inorganic and Analytical Chemistry, Faculty of Chemistry and Pharmacy, Albert-Ludwigs-Universität Freiburg, Germany	Crystal growth and characterisation of organic-inorganic lead-free 2D double perovskite for application in radiation sensin
Schwieger, Wilhelm	Institute of Chemical Reaction Engineering, Friedrich-Alexander-University Erlangen-Nürnberg, Erlangen, Germany	Coupled ptychography and tomography reconstruction of experimental data
Scott, Connor	The University of Queensland, Brisbane, QLD, Australia	High-resolution structures of immature and chimeric flaviviruses reveal key features redefining viral architecture and maturation
Scott, Emily E.	University of Michigan, Ann Arbor, MI, Unites States	Using Ancestral Sequence Reconstruction to Create Robust, Highly Expressed Proteins for Crystallography
Scouflaire, Philippe	EM2C, Centralesupelec, Gif sur Yvette, France	Analysis of the experimental parameters impacting Non-Photochemical Laser-Induced nucleation of glycine in water
Šebová, Radka	Biomedical Research Center, Slovak Academy of Sciences, Bratislava, Slovak Republic	Molecular characterization of the native (non-linked) CD160-HVEM protein complex revealed by initial crystallographic analysis
Secci, Fausto	University of Cagliari, Monserrato (CA), Italy	From CO₂ to dimethyl ether: mesostructured acidic oxides for methanol dehydration to design bifunctional catalysts Presenter
Sechadri, Srivatsan	Sigray, Inc., concord, United States of America	Holistically Optimized Laboratory XAS Systems
Šedo, Ondrej	CEITEC MU, Brno, Czech Republic	Receptor induced rearrangements of capsid and genome prime rhinovirus 14 for activation and uncoating
Seeck, Oliver	DESY Photon Science, Hamburg, Germany	Conceptual design of a scattering/diffraction beamline for the Russian synchrotron Ultimate Source for Synchrotron Radiation
Segets, Doris	Process Technology for Electrochemical Functional Materials and Center for Nanointegration Duisburg-Essen (CENIDE), University Duisburg-Essen, Germany	Interplay between size, morphology, microstructure defects and optoelectronic properties of CdSe nanocrystals
Seguin, Ana Karina	Andres Bello, Departamento de Ciencias Químicas, Santiago, Chile; Centro para el Desarrollo de la Nanociencia y Nanotecnología, CEDENNA, Santiago, Chile	One-dimensional coordination polymers based on cobalt(II) and nickel(II)
Segura Mora, Joan	Research Collaboratory for Structural Bioinformatics Protein Data Bank. San Diego Supercomputer Center, University of California, San Diego, La Jolla	3DBionotes Covid-19 Edition
Seikh, MD Motin	Department of Chemistry, Visva-Bharati University, Santiniketan 731235, West Bengal, India	Designing Composite Spin Chain Structures Built up of Dimeric and Trimeric Polyhedral Units: The oxides A_1+y[(Mn_1-xCo_x)_1-z◊_z]O₃ (A=Ca, Sr; x = 3/8).
Seiner, Hanuš	Institute of Thermomechanics of the Czech Academy of Sciences, Dolejškova 1402/8, 18200 Prague 8, Czech Republic	Hysteretic structural changes within five-layered modulated 10M martensites of Ni-Mn-Ga(-Fe)
Sekine, Akiko	Department of Chemistry, Tokyo Institute of Technology, Tokyo, Japan	In situ control of Photochromic properties with dual photoreactive soft crystal Presenter Mechanism elucidation of Stepwise dehydration of pharmaceutical hydrate crystals by structure determination from powder diffraction data
Sekine, Toshinari	Tokyo Printing Ink Mfg. Co., Ltd., Saitama, Japan	Three differently-colored polymorphs of a diketopirolopyrrole derivative having butyl groups
Semenok, Dmitrii	Skolkovo Institute of Science and Technology, Moscow, Russian Federation	Computational search for new high-T_C superconductors based on lanthanoid and actinoid hydrides at moderate pressures Room-temperature superconductivity in compressed polyhydrides Presenter
Semrau, Marta Stefania	University of Trento, Department of Cellular, Computational and Integrative Biology (CIBIO), Trento, Italy.; Protein Facility, Elettra Sincrotrone Trieste S.C.p.A, Italy	Structural characterization of the PTG and PTG/PP1 complex Presenter
Semwal, Shubham	Centre National de REcherche Scientifique, Villeneuve d'Ascq, France	Seeing is believing: glycosylation in the crystal structure of human myeloperoxidase
Semwal, Shubham	Unité de Glycobiologie Structurale et Fonctionnelle, UMR 8576, CNRS, 50 Avenue Halley, 59650 Villeneuve d'Ascq, France	Structural studies of Cysteine Synthase Complex obtained from Klebsiella pneumoniae. Presenter
Sen, Subhabrata	Shiv Nadar University, Greater Noida, India	Importance of Polymorphism in Improving the Potency of Bioactive Molecules
Sencadas, Vitor	School of Mechanical, Materials, Mechatronic and Biomedical Engineering, University of Wollongong, Wollongong, NSW, 2522, Australia	Millisecond structural dynamics during the piezoelectric cycle of silk fibroin by synchrotron X-ray scattering & comparison with DFT calculation
Senda, Toshiya	High Energy Accelerator Research Organization, Tsukuba, Japan	Automated crystal shaping to facilitate native SAD phasing
Senda, Toshiya	Structural Biology Research Center, Institute of Materials Structure Science, High Energy Accelerator Research Organization, 1-1 Oho, Tsukuba, Ibaraki, Japan; School of High Energy Accelerator Science, The Graduate University for Advanced Studies, 1-1 Oho, Tsukuba, Ibaraki, Japan	Fully automated data collection and remote access in macromolecular crystallography beamlines at the Photon Factory, Japan
Senda, Toshiya	High Energy Accelerator Research Organization (KEK), Ibaraki, Japan	Structural analysis of transcription related complexes and operation of 200kV cryo-EM in KEK
Senda, Toshiya	Structural Biology Research Center, High Energy Accelerator Research Organization	Development of microspectrophotometer for the macromolecular crystallography beamline at the Photon Factory, Japan
Senin, Roman A.	NRC “Kurchatov Institute” – Institute for Theoretical and Experimental Physics, Moscow, Russia	Conceptual design of a scattering/diffraction beamline for the Russian synchrotron Ultimate Source for Synchrotron Radiation
Senn, Mark S.	University of Warwick, Coventry, United Kingdom	Striping of orbital-order with charge-disorder in optimally doped manganites The solid-state chemistry of rhodium(I) pincer complexes under extreme conditions.
Sequeira, André	ITQB – Instituto de Tecnologia Química Biológica, Universidade Nova de Lisboa, 2780-157 Oeiras, Portugal.	Biosynthesis of mycobacterial methylmannose polysaccharides requires a unique 1-O-methyltransferase specific for 3-O-methylated mannosides
Seregin, Alexei	NRC “Kurchatov institute”, 1, Akademika Kurchatova pl., Moscow, Russia, 123182; FSRC “Crystallography and photonics” RAS, 59, Leninskii pr., Moscow, Russia, 119333	Studies of the functional characteristics of adaptive X-ray optical elements based on combination of longitudinal and transverse acoustic waves in wide frequency ranges
Seregin, Alexey	National Research Centre “Kurchatov Institute”	The organization of stable pre-crystallization phase from oligomers in lysozyme solution with different precipitates and the thin films formation at the air-liquid/air-substrate interfaces from the crystallization solutions
Serezhkin, Viktor N.	Samara National Research University, Samara, Russian Federation	The phenomenon of polymorphism within the stereoatomic model of crystal structures
Serquis, A.	INN-CNEA-CONICET, Av. Bustillo 9500, S. C. de Bariloche, Río Negro, 8400, Argentina	Combined structural and electrical characterization of zirconia-based thin films for energy applications
Serquis, Adriana	Instituto de Nanociencia y Nanotecnología, CNEA-CONICET, Av. Bustillo 9500 Bariloche, Argentina; Comisión Nacional de Energía Atómica, Av. Bustillo 9500 Bariloche, Argentina; Departamento de Caracterización de Materiales, CAB-INN-CONICET-CNEA, Bariloche, Argentina	Effect of nano-SiC doping on the structure and superconducting properties of Mg (B_1-xC_x)₂ Synthesis, characterization of high-temperature properties and evaluation of REBa2Cu3O6+δ (RE = La, Nd and Y) as cathode for Intermediate Temperature Solid Oxide Fuel Cells.
Serrano-Sánchez, Federico	ICMM-Madrid, Spain	Unveiling the Structural Behavior under Pressure of Filled M_0.5Co₄Sb₁₂ (M = K, Sr, La, Ce, and Yb) Thermoelectric Skutterudites
Serre, Christian	Institut des matériaux poreux de Paris, Ecole normale supérieure, ESPCI, CNRS, PSL University, Paris, France	Low-dose imaging of metal-organic frameworks and study of their electron-beam stability
Servage, Kelly A.	UT Southwestern Medical Center, Dallas, United States of America	Structural and mechanistic basis for protein glutamylation by the kinase fold
Seryotkin, Yurii	Novosibirsk State University, Novosibirsk, Russian Federation; V.S. Sobolev Institute of Geology and Mineralogy SB RAS, Novosibirsk, Russian Federation	Salts of guanine and alkali metals: preparation and structural study at broad range of T, P
Seth, Sohan	University of Edinburgh, Edinburgh, United Kingdom	New generalized crystallographic descriptors for structural machine learning
Setkova, Tatiana V.	D.S. Korzhinskii Institute of Experimental Mineralogy RAS, Chernogolovka, Russian Federation	⁵⁷Fe Mössbauer spectroscopy study of the Fe-bearing, Ge,Ga-rich synthetic tourmalines
Setoyama, Hiroyuki	Kyushu Synchrotron Light Research Center (Tosu, Saga, Japan)	Extracting local symmetry of liquid metals from extended x-ray absorption fine structure using deep neural network
SEYNOU, Mohamed	University Joseph Ki-Zerbo, Ouagadougou, Burkina Faso	Geopolymers based on some clay from Burkina Faso : preparation and characterization
Shabalin, Ivan	University of Virginia, Charlottesville, United States of America	Rapid response to biomedical challenges and threats
Shafiq, Mohsin	UKE, Hamburg, Germany	A pipeline for time-resolved small-angle X-ray scattering data analysis on amyloid fibrils formation in solution
Shahrezaei, Sina	Department of Materials Science and Engineering, University of California Riverside, Riverside, CA, USA	Scanning Nano-Structure Electron Microscopy - Hidden Potential for Evolving Systems
Shalev-Benami, Moran	Department of Chemical and Structural Biology, Weizmann Institute of Science, Rehovot, Israel	To eat or not to eat: Cryo-EM structure of melanocortin receptor 4 reveals mechanism of a “hunger switch” initiating satiety signaling.
Shalimov, Artem	Rigaku Europe SE, Neu-Isenburg, Germany	Rigaku’s SmartLab XRD tool: All cutting-edge technologies in one instrument.
Shang, Tian	Laboratory for Multiscale Materials Experiments, Paul Scherrer Institut, 5232 Villigen PSI, Switzerland; Paul Scherrer Institut, Villigen, Switzerland	Distortion mode anomalies at T_MIT = T_Nin bulk PrNiO₃ Magnetic phase diagram of the high-temperature spiral magnet YBaCuFeO₅
Shanklin, John	Biology Department, Brookhaven National Laboratory, Upton, NY 11973-5000, United States	Co-crystallization of hepatitis C virus NS3/4A inhibitors and SARS-CoV-2 main protease using high density acoustic droplet ejection (ADE)
Shanks, Kate	Cornell High Energy Synchrotron Source, Ithaca, United States of America	A multiscale, multimodal approach to studying static recrystallization in Mg-3Zn-0.1Ca
Shao, Yu-Tsun	University of Illinois at Urbana-Champaign, Urbana, United States of America	Real space frequency analysis of electron diffuse scattering for lattice distortion determination in real crystals
Shapiro, David	Advanced Light Source, Lawrence Berkeley National Laboratory, Berkeley, CA 94720, United States	Collaborative software solutions and data standards for ptychographic Imaging
Shapovalov, V.	Southern federal university, Rostov on-Don, Russian Federation	Facile synthesis of nano-structure LiCoPO₄@UiO-66 particles and its in-situ XAS, structural properties and electrochemical characterization for lithium batteries
Shapovalov, Victor Vasilevich	Smart Materials Research Institute, Southern Federal University, Rostov-on-Don, Russian Federation	Operando diagnostics of cathode materials based on novel sodium iron titanites Presenter Temperature and time-resolved XANES studies of novel valence tautomeric cobalt complex
Shapovalov, Victor Vasilievich	The Smart Materials Research Institute, Rostov-on-Don, Russian Federation	Ultraviolet-assisted synthesis and structural characterization of the Pd nanoparticles on the CeO₂ substrate
Shapovalova, Svetlana Olegovna	The Smart Materials Research Institute, Southern Federal Universuty, Rostov-on-Don, Russian Federation	Temperature and time-resolved XANES studies of novel valence tautomeric cobalt complex Presenter
Sharma, Hem Raj	The University of Liverpool, Liverpool, United Kingdom	Epitaxial Thin Films on Tsai-type Quasicrystals
Sharpe, May E.	Paul Scherrer Institut, Villigen-PSI, Switzerland	Batch crystallisation methods for serial crystallography experiments
Sharpe, May Elizabeth	Paul Scherrer Institut, Villigen, Switzerland	Automated data collection at the Swiss Light Source macromolecular crystallography beamlines
Sheikh, Ahmad	Solid-State Chemistry, Abbvie, North Chicago, United States of America	A Novel Physics-based Ensemble Modeling Approach that Utilizes Crystal Packing to Predict Aqueous Thermodynamic Solubility
Sheldrick, George M.	University Göttingen, Germany	Different methods for phasing diffraction data – macromolecules
Shelley, Kathryn	School of Chemistry, University of Bristol, Cantock’s Close, Bristol, BS8 1TS, United Kingdom; Dept of Biochemistry, University of Oxford, Oxford, OX1 3QU, United Kingdom	A “post-mortem” analysis of radiation damage in the Protein Data Bank with the B_net metric
Shen, Chen	Institute of Materials Science, Technical University of Darmstadt, 64287 Darmstadt, Germany	CCDCGAN: Deep learning prediction of crystal structures
Shen, Tao	Paul Scherrer Institut, Villigen PSI, Switzerland	Ptychographic image reconstruction using total variation regularization
Shepherd, Helena	School of Physical Sciences, Ingram Building, University of Kent, Canterbury, CT2 7NH; University of Kent, Canterbury, United Kingdom	Crystal engineering concepts in the design and synthesis of a series of novel, structurally related spin-crossover materials, characterized by variable temperature single crystal X-ray diffraction. Smart Molecular Materials: Synthesis, Structure and Properties
Sheppard, Charles	Cr Research group, Department of Physics, University of Johannesburg, Auckland Park, Johannesburg, 2006, South Africa	The magnetic-structural relationships of [CuX₆]^4- [X = Cl^-or Br^-] perovskites containing n-carboxyalkylammonium cations of various chain lengths
Sheppard, Thomas L.	Institute for Chemical Technology and Polymer Chemistry, Karlsruhe Institute of Technology, Karlsruhe,, Germany; Institute of Catalysis Research and Technology, Karlsruhe Institute of Technology, Eggenstein-Leopoldshafen, Germany	Coupled ptychography and tomography reconstruction of experimental data
Sheptyakov, Denis	Laboratory for Neutron Scattering and Imaging, Paul Scherrer Institut, 5232 Villigen PSI, Switzerland	Distortion mode anomalies at T_MIT = T_Nin bulk PrNiO₃ Novel incommensurate magnetic phase in the magnetoelectric Sr-doped cobaltate CaBaCo₄O₇
Sherin, Peter S.	Novosibirsk State University, Novosibirsk, Russian Federation; International Tomography Center	The role of S-bond in tenoxicam keto–enolic tautomerization.
Shi, Ji	Tokyo Institute of Technology, Tokyo, Japan	Self-consistent diffraction stress analysis for estimating stress and composition of alloy films
Shi, Wuxian	Center for BioMolecular Structure, NSLS-II, Brookhaven National Laboratory, Upton, NY 11973-5000, United States	Co-crystallization of hepatitis C virus NS3/4A inhibitors and SARS-CoV-2 main protease using high density acoustic droplet ejection (ADE)
Shi, Yun	University of Queensland, Brisbane, Australia	Crystal and Cryo-EM structures provide insight into how pro-neurodegenerative SARM1 is activated and cleave NAD⁺.
Shibata, Norio	Life Science and Applied Chemistry, Graduate School of Engineering, Nagoya Institute of Technology	Structural insight into the degradation selectivity of C2H2 zinc finger by thalidomide metabolite
Shibata, Norio	Graduate School of Engineering, Nagoya Institute of Technology, Nagoya, Japan.	Crystal growth and optical study of thalidomide
Shibayama, Mitsuhiro		Introduction to session Presenter
Shibayama, Mitsuhiro	Comprehensive Research Organization for Science and Society, Tokai, Japan	Fabrication and characterization of inhomogeneity-free polymer gels Presenter
Shibuya, Asuka	Faculty of Pharmaceutical Sciences, Tokyo University of Science	Structure determination of the motor domain of centromere associated protein E Presenter
Shigeta, Kazuya	Nippon Gijutsu Center Co. Ltd, Hyogo 679-5148, Japan	Picometer-level core-shell structure in Pd nanocrystals revealed by total scattering
Shih, Orion	National Synchrotron Radiation Research Center, Hsinchu,Taiwan	Solution Structures of Intrinsically Disordered Dipeptide-Repeats Studied by SAXS and Molecular Structure Simulation Stoichiometric unfolding of bovine serum albumin by surfactant, as revealed from HPLC/SAXS with online observation of UV-Vis absorption and refractive index. A New Biological Small- and Wide-Angle X-ray Scattering Beamline Featured in High Flux, USAXS, and Microbeam at Taiwan Photon Source Aggregation Forms of Type I Collagen Studied by Simultaneous Small- and Wide-Angle X-ray Scattering
Shih, Orion	National Synchrotron Radiation Research Center, Hsinchu Science Park, Hsinchu 30076, Taiwan	Data treatment and data storage at the BioSAXS beamline TPS 13A Structural characterization of liposomes using integrated methods of HPLC/AF4, UV-Vis absoprtion, Refractive Index, MALLS, DLS, and SAXS
Shimakawa, Yuichi		Introduction to session Presenter
Shimakawa, Yuichi	ICR, Kyoto University, JP; Institute for Chemical Research, Kyoto University, Kyoto, Japan	Complex A-site magnetism in quadruple perovskite materials Synthesis and investigation of the 4H and newly discovered 6H perovskite polymorphs of BaRhO₃ between 7 – 22 GPa.
Shimizu, Masahiro	Kyoto University, Osaka, Japan	AUC-SAS: Integrated analysis of biomacromolecular structure with analytical ultracentrifugation (AUC) and small-angle scattering (SAS) Dynamics of multi-domain protein ER-60 revealed by small angle X-ray scattering data and molecular dynamics simulations Presenter Establishment of basic techniques related to protein sample preparation for neutron scattering Subunit dynamics in alpha-crystallin through deuteration-assisted small-angle neutron scattering
SHIMIZU, Nobutaka	High Energy Accelerator Research Organization (KEK)	Crystal structure of atypical ubiquitin ligase PCAF_N Small-angle X-ray scattering beamlines at the photon factory Presenter
SHIMIZU, Toshiyuki	The University of Tokyo	Crystal structure of atypical ubiquitin ligase PCAF_N
Shimoyama, Yusuke	Tokyo Institute of Technology, Tokyo, Japan	A comparative research between atomic-based and chemical calculation-based descriptor for cocrystal screening machine learning model Presenter High-pressure CO₂ for lipid-mediated cocrystallization of theophylline and nicotinamide Presenter
Shinmei, Toru	Geodynamics Research Center, Ehime University, Matsuyama 790-8577, Japan	Reinvestigation of site-disorder in dense ice by in-situ neutron diffraction techniques
Shinoda, Akira	High Energy Accelerator Research Organization, Tsukuba, Japan	Automated crystal shaping to facilitate native SAD phasing
Shinoda, Akira	Structural Biology Research Center, Institute of Materials Structure Science, High Energy Accelerator Research Organization, 1-1 Oho, Tsukuba, Ibaraki, Japan	Fully automated data collection and remote access in macromolecular crystallography beamlines at the Photon Factory, Japan
Shinoda, Akira	High Energy Accelerator Research Organization (KEK), Ibaraki, Japan	Structural analysis of transcription related complexes and operation of 200kV cryo-EM in KEK
Shinoda, Akira	Faculty of Advanced Life Science, Hokkaidou University, Sapporo, Japan	A solution-free crystal-mounting platform for native SAD
Shinohara, Takenao	Japan Proton Accelerator Research Complex (J-PARC), Japan	Trindex - 3D Grain Orientation Mapping with Neutron Imaging
Shirani, S.	Universidad de Malaga, Malaga, Spain	Quantitative analysis of cementitious materials by X-ray ptychographic nanotomography Presenter
Shiri, Samira	Rowland Institute, Harvard University, Cambridge, MA, USA	A high-throughput method for combinatorial screening of metal nanoparticles using x-ray pair distribution function analysis
Shiro, Genki	Department of Biophysics, Kyoto University, Kyoto, Japan	Symmetry breaking and Optical property of high-temperature superconductor Bi₂Sr₂CaCu₂O_8+δ
Shitsevalova, Natalya Yu.	Institute for Problems of Materials Science, NASU, Kyiv, Ukraine	Rare-earth dodecaborides: still cubic or not?
Shiu, Ying-Jen	National Synchrotron Radiation Research Center, Hsinchu, Taiwan	Aggregation Forms of Type I Collagen Studied by Simultaneous Small- and Wide-Angle X-ray Scattering Presenter
Shmulevich, Fannia	Department of Life Sciences, Ben-Gurion University of the Negev, Beer-Sheva, Israel	SAMase of bacteriophage T3 inactivates E. coli’s methionine Sadenosyltransferase by forming hetero-polymers
Shoinkhorova, Tuiana	King Abdullah University of Science and Technology, KAUST Catalysis Center, Advanced Functional Materials, Thuwal 23955, Saudi Arabia	Spectral X-ray ptychography for the investigation of technical catalysts
Shrive, Annette	Keele University, Staffordshire, United Kingdom	Lipopolysaccharide Recognition by human Surfactant Protein D. Structural studies of C-reactive Protein
Shrive, Annette K	School of Life Sciences, Keele University, Keele, United Kingdom	Bacterial lipopolysaccharide recognition by surfactant protein D Presenter
Shu, Deming	Argonne National Laboratory, Lemont, United States of America	Possibilities at the Polar beamline at APS
Shukaev, Igol Leonidovich	Department of Chemistry, Southern Federal University, Rostov-on-Don, Russian Federation	Operando diagnostics of cathode materials based on novel sodium iron titanites
Shultz, David	Department of Chemistry, North Carolina State University, Raleigh, NC 27695‐8204, USA	Mapping the thermo-induced valence tautomerism in Cobalt dioxolane single crystals
Shundo, Atsuomi	Department of Automotive Science, Kyushu University, Fukuoka, Japan	Evolution of heterogeneity and gelation of poly(N‑isopropylacrylamide) aqueous solution at a temperature below cloud point Presenter
Shunnar, Abeer F.	Khalifa University of Science and Technology, Abu Dhabi, United Arab Emirates	Expanding the crystal form landscape: emerging computational tools for the discovery of eutectic composites and higher-order cocrystals of organic compounds
Shyam, Priyank	Aarhus University, Aarhus C, Denmark	The journey from disorder to order: transformation of ferrite magnets investigated in situ by combined Bragg & total scattering analysis Presenter
Sibilia, Mirta	Nuclear Science and Instrumentation Laboratory, Physics section, IAEA, Seibersdorf, Austria	A multidisciplinary study unveils the nature of a Roman ink of the I century AD
Sibille, Roman		Introduction to session Presenter
Sicairos, Manuel Guizar		Introduction to session Presenter
Šícha, Václav	Institute of Inorganic Chemistry of the Czech Academy of Sciences	Structure-assisted design of inhibitors of CA IX enzyme based on polyhedral boron compounds
Siddiqui, Mohd. Quadir	Alberta RNA Research and Training Institute, Department of Chemistry and Biochemistry, University of Lethbridge, 4401 University Drive, Lethbridge, AB T1K 3M4, Canada	Structural Characterization of missense mutation identified in BRCA2 using Comparative Biophysical and Dynamics Studies
Sidis, Yvan	Laboratoire Léon Brillouin (CEA-CNRS), Université Paris-Saclay CEA Saclay, 91191 Gif-sur-Yvette, France.	Dynamical Properties of the Incommensuratly Modulated Rb₂ZnCl₄ Phase
Sidletskiy, Oleg	Institute for Scintillation Materials NAS of Ukraine, Kharkiv, Ukraine	Synthesis of magnetically frustrated oxides with double perovskite structure
Sier, Daniel	University of Melbourne, Melbourne , Australia	High accuracy determination of photoelectric crosssections, X-ray Absorption Fine Structure and nanostructure analysis of zinc selenide using the X-rayExtended Range Technique
Sierecki, Emma	EMBL Australia Node in Single Molecule Science, University of New South Wales, Kensington, New South Wales, Australia	MyD88 TIR domain higher-order assembly interactions revealed by microcrystal electron diffraction and serial femtosecond crystallography MyD88 TIR domain higher-order assembly interactions revealed by serial femtosecond crystallography
Sikharulidze, Irakli	Diamond Light Source, Didcot, United Kingdom	Predicting experimental phasing success for data triaging
Sikolenko, Vadim	Joint Institute for Nuclear Research, Frank Laboratory of Neutron Physics, Joliot-Curie 6, Dubna 141980, Russia	Mechanisms of elastic-plastic deformation in magnesium alloy studied using neutron diffraction and crystallite group method
Šiková, Michaela	Institute of Microbiology of the Czech Academy of Sciences, Prague, Czech Republic	Deciphering the role of unique bacterial transcription-associated factor HelD.
Silk, Ryan	School of Chemical Sciences, University of Auckland, 23 Symonds Street, Auckland 1010, New Zealand; Macdiarmid Institute for Advanced Materials and Nanotechnology, Victoria University of Wellington, Wellington 6140, New Zealand	Memes: a new avenue for spreading crystallographic knowledge for the next generation
Silva, Bruna N. N.	Group of Phys. Chem. of Solids and Interfaces, Depart. Chem., Universidade Federal de Juiz de Fora, Brazil	The long-time elusive structure of magadiite,solved by 3D electron diffraction and model building
Silva, Marco Antonio Leandro da	Departamento de Geologia, Universidade Federal de Ouro Preto, Brazil	What are the crystallographic and genetic implications of a naturally occurring polycrystal composed of two mineral phases of distinct symmetries and anionic groups? The case study of “joint-occurrence” of emerald+alexandrite polycrystals from Brazil
Simancas, J.	Instituto de Tecnología Química (UPV-CSIC) Universitat Politècnica de València-Consejo Superior de Investigaciones Científicas, Valencia, SPAIN	Use of alkylarsonium cations as probe molecules for the study of zeolites
Simbrunner, Josef	Graz Medical University, Graz, Austria	GIDInd: an automated indexing software for grazing-incidence X-ray diffraction data Presenter An efficient method for indexing grazing-incidence X-ray diffraction data of epitaxially grown thin films Presenter
Simola, Roberto	STMicroelectronics, 190 Ave Coq, 13106 Rousset, France	Investigating the crystallization behavior of Ge-rich GST PCMs with in-situ synchrotron XRD
Simon-Baram, Hadas	Department of Life Sciences, Ben-Gurion University of the Negev, Beer-Sheva, Israel	SAMase of bacteriophage T3 inactivates E. coli’s methionine Sadenosyltransferase by forming hetero-polymers Presenter
Simone, Mascotto	Institut für Anorganische und Angewandte Chemie, Universität Hamburg, Germany.	Direct observation of the xenon physisorption process in mesopores by combining in situ Anomalous Small-Angle X‑ray Scattering and X‑ray Absorption Spectroscopy
Simone, Raoux	Helmholtz-Zentrum Berlin für Materialien und Energie, Berlin, Germany; Institut für Physik, Humboldt-Universität zu Berlin, Germany	Direct observation of the xenon physisorption process in mesopores by combining in situ Anomalous Small-Angle X‑ray Scattering and X‑ray Absorption Spectroscopy
Simonet, Virginie		Introduction to session Presenter
SIMONET, VIRGINIE	Univ. Grenoble Alpes, CNRS, Grenoble INP, Institut Néel, 38000 Grenoble, France; Institut Néel, CNRS, Grenoble, France	Ba₃NbFe₃Si₂O₁₄:a model system to study magnetic chirality Dimer physics in the frustrated Cairo pentagonal antiferromagnet Bi₂Fe₄O₉
Simonov, Arkadiy	ETH Zurich, Zurich, Switzerland	Metastable disordered phase in flash-frozen Prussian Blue Analogues Tuning of disordered local structure in Prussian Blue analogues Yell: Diffuse scattering analysis in single crystals
Simpkin, Adam J	Institute of Integrative Biology, University of Liverpool, Liverpool L69 7ZB, England	Exploiting new generation ab initio and homology models from databases for MR Presenter
Simpkin, Adam James	University of Liverpool, Liverpool, United Kingdom	SIMBAD: Sequence independent MR Using next generation ab initio models with AMPLE
Sinclair, Ryan	Department of Physics and Astronomy, University of Tennessee, Knoxville, TN 37996, USA	The local structure fingerprint of dual orbital degeneracy lifting in a strongly correlated electron system
Sindelar, Charles V	Dept of Molecular Biophysics and Biochemistry, Yale School of Medicine, New Haven, USA	An asymmetric structure of the filament is key to inducing flagellar curvature and enabling motility in the Leptospira spirochete
Singh, Bharti	Indian Institute of Technology Delhi, Delhi, India	Magnetic aspects and assemblies of solvent-mediated layered manganese dicarboxylate based coordination polymers Presenter
SINGH, GURVINDERJIT	Raja Ramanna Centre for Advanced Technology, Indore, India	Ferroelectricity driven by ‘A’ and ‘B’ site off-centered displacements in cubic phase with Pm-3m space group
Singh, Harkesh	Indian Institute of Technology; IITB-Monash Research Academy	Seleninic acids as chalcogen bond donors: a molecular insight of GPx activity
Singh, Pragya	Indian Institute of Technology (Banaras Hindu University), Varanasi 221005, India	Evidence for pressure induced ‘morphotropic’, octahedral tilt and ‘reentrant’ ferroelectric transitions in (Pb_0.5Bi_0.5)(Ti_0.5Fe_0.5)O₃ Presenter
Sisak Jung, Dubravka	DECTRIS, Baden-Daettwil, Switzerland	Crystallographic education in real and reciprocal spacechromechrome Difficult structures of organic molecules and how to solve them
Sittner, Petr	Institute of Physics, Czech Republic	Trindex - 3D Grain Orientation Mapping with Neutron Imaging
Sivaraman, Komagal	Infection and Immunity Program and Department of Biochemistry and Molecular Biology, Biomedicine Discovery Institute, Monash University, Clayton, Victoria, Australia	The structure of the marsupial γμ T cell receptor defines a third T cell lineage in vertebrates
Sixta, Herbert	Aalto University, Finland	The colloidal structure of a regenerated cellulose fiber
Sjöhamn, Jennie	University of Gothenburg, Gothenburg, Sweden.	The structure of the ABC transporter PsaBC shows that bacterial manganese import is achieved by unique architectural features that are conserved across the kingdoms of life.
Skálová, Tereza	Institute of Biotechnology of the Czech Academy of Sciences, Vestec, Czech Republic	Deciphering the role of unique bacterial transcription-associated factor HelD.
Skálová, Tereza	Institute of Biotechnology of the Czech Academy of Sciences, v.v.i., Průmyslová 595, 252 50 Vestec, Czech Republic	FAD-dependent oxidoreductase from Chaetomium thermophilum: Crystallographic fragment screening-based identification of putative substrates
Skalova, Tereza	Institute of Biotechnology CAS, v.v.i., Vestec, Czech Republic	Influence of glycosylation on the structure of human natural killer cell receptor NKp30 in complex with its tumor ligand B7-H6 Presenter
Skálová, Tereza	Institute of Biotechnology of the Czech Academy of Sciences, Biocev	Finding the optimal resolution cutoff with PAIREF
Skinner, Stephen John	Imperial College London, London, United Kingdom	Investigating the modulated structures in the La(Nb,W)O_4+d family of oxide ion conductors Presenter
Skjaervoe, Sandra H.	Columbia University, New York	Local structure representation beyond symmetry constraints: Glazer tilts in perovskites Presenter
Skořepa, Ondřej	Department of Biochemistry, Faculty of Science, Charles University Prague, Hlavova 8, 128 40 Praha, Czech Republic	Influence of glycosylation on the structure of human natural killer cell receptor NKp30 in complex with its tumor ligand B7-H6
Skorynina, Alina	Southern Federal University, Rostov-on-Don, Russia; The Smart Materials Research Institute of Southern Federal University	Detailed information about the core/shell/surface structure of palladium nanoparticles by combined in situ and operando X-ray absorption and diffraction data Presenter Machine learning applied to operando XANES spectroscopy for Pd nanocatalysts X-ray absorption spectroscopy study of metal-organic frameworks functionalized by Pd: Formation and growth of Pd nanoparticles XAS and XRD analysis of active Pt and Pd sites in metal-organic framework UiO-67 Presenter
Skovhede, Kenneth	MAX IV Laboratory, Lund University, Sweden; Niels Bohr Institute, University of Copenhagen, Denmark	Azimuthal integration and crystallographic algorithms on field-programmable gate arrays
Skrodczky, Kai	Humboldt University, Berlin, Germany	From CO₂ to dimethyl ether: mesostructured acidic oxides for methanol dehydration to design bifunctional catalysts
Skumryev, Vassil	Universitat Autonoma de Barcelona, Spain	Dimer physics in the frustrated Cairo pentagonal antiferromagnet Bi₂Fe₄O₉
Skyner, Rachael	Diamond Light Source Ltd, Didcot, United Kingdom; Research Complex at Harwell, Harwell Science and Innovation Campus, Didcot, OX11 0FA, UK	Crystallographic fragment screening of SARS-CoV-2 drug discovery targets
SLASSI, Siham	Moulay Ismail University faculty of Science Meknes, Meknes, Morocco	Copper(II) and zinc(II) complexes based on azo Schiff base ligand: Synthesis, crystal structure and photoisomerization study Presenter
Slater, Peter Raymond	School of Chemistry, The University of Birmingham, Edgbaston, B15 2TT, UK	The Building Blocks of Battery Technology: Inspiring the next generation of battery researchers
Slep, Leonardo D.	University of Buenos Aires, CABA, Argentine	Synthesis & crystallographic, spectroscopic and computational characterization of O-R substituents effects on the torsional angle of 3,3\',4,4\' substituted biphenyls
Ślepokura, Katarzyna Anna	University of Wrocław, Wrocław, Poland	Architecture of hydrogen-bonded anionic substructure vs cation type in thiazolium hypodiphosphates
Sliwiak, Joanna	Center for Biocrystallographic Research, Institute of Bioorganic Chemistry, Polish Academy of Sciences, Poznan, Poland	A novel, statistical approach for structure determination of modulated pathogenesis-related protein (Hyp-1) complex with ANS
Sluchanko, Nikolay E.	Prokhorov General Physics Institute, RAS, Moscow, Russian Federation	Rare-earth dodecaborides: still cubic or not?
Slyshkina, Ekaterina	University of Zurich, Zurich, Switzerland	Crystallization of anionic small molecules with the help of a cation screen
Smeets, Stef	Netherlands eScience Center, Amsterdam, The Netherlands	In the age of electrons, do we still need powder diffraction?
Šmerdová, Lenka	CEITEC MU, Brno, Czech Republic	Receptor induced rearrangements of capsid and genome prime rhinovirus 14 for activation and uncoating
Smerechuk, Anastasiia	Institute for Solid-State and Materials Research, Dresden, Germany; Institute for Scintillation Materials NAS of Ukraine, Kharkiv, Ukraine	Synthesis of magnetically frustrated oxides with double perovskite structure Presenter
Smietanska, Joanna Maria	AGH University of Science and Technology, Krakow, Poland	A novel, statistical approach for structure determination of modulated pathogenesis-related protein (Hyp-1) complex with ANS Presenter
Šmilauerová, Jana	Charles University, Prague, Czech Republic	Phase transformation pathway in Ti-15Mo studied by in situ synchrotron x-ray diffraction
Šmilauerová, Jana	Department of Physics of Materials, Charles University, Praha 2, Czech Republic	α phase lamellae orientation relationship in metastable β titanium alloys
Smirnova, Ekaterina	Shubnikov Institute of Crystallography of FSRC “Crystallography and Photonics” RAS, 119333, Moscow, Russia; Shubnikov Institute of Crystallography of Federal Scientific Research Centre “Crystallography and Photonics” of Russian Academy of Sciences, Moscow, Russian Federation	Crystal structure and Mössbauer studies of gallium iron borate single crystals Hyperfine interactions of ⁵⁷Fe nuclei in a weak ferromagnet FeBO₃
Smirnova, Ekaterina S.	FSRC «Crystallography and Photonics» RAS, Leninskiy Prospekt 59, Moscow, 119333 Russia	Structural peculiarities of bismuth-containing RFe₃(BO₃)₄ (R = Ho, Y, Sm, Nd) Presenter
Smith, Clyde	Stanford Synchrotron Radiation Lightsource, Stanford University, Menlo Park, California, USA	Structural and mechanistic studies on carbapenem-hydrolysing class D serine β-lactamases leading to improved inhibitor design Presenter
Smith, K.M.	School of Biomedical Sciences, Charles Sturt University, Wagga Wagga, NSW, Australia	Understanding viral host interactions that modulate nuclear transport and innate immunity
Smith, Kate	The Australian Synchrotron, Clayton, VIC, Australia	Exploring the mechanism of elastically flexible crystals by automatic analysis
Smith, Kate Mary Louise	Paul Scherrer Institut, Villigen, Switzerland	Automated data collection at the Swiss Light Source macromolecular crystallography beamlines
Smith, Mark	School of Chemical Sciences, University of Auckland, 23 Symonds Street, Auckland 1010, New Zealand; Macdiarmid Institute for Advanced Materials and Nanotechnology, Victoria University of Wellington, Wellington 6140, New Zealand	Memes: a new avenue for spreading crystallographic knowledge for the next generation
Smith, Raymond	Lawrence Livermore National Laboratory, Livermore, United States of America	Investigations of the high-pressure, high-temperature behaviour of Au using laser-driven dynamic compression
Smyshlyaev, Georgy	University of Geneva, Geneva, Switzerland; Structural and Computational Biology Unit, European Molecular Biology Laboratory, Heidelberg, Germany; European Bioinformatics Institute, European Molecular Biology Laboratory, Hinxton, UK	Structural insights into the transposition of antibiotic resistance
Snegirev, Nikita	Shubnikov Institute of Crystallography of Federal Scientific Research Centre “Crystallography and Photonics” of Russian Academy of Sciences, Moscow, Russian Federation	Hyperfine interactions of ⁵⁷Fe nuclei in a weak ferromagnet FeBO₃ Presenter
Snegirev, Nikita	Shubnikov Institute of Crystallography of FSRC “Crystallography and Photonics” RAS, 119333, Moscow, Russia	Crystal structure and Mössbauer studies of gallium iron borate single crystals
Snell, Edward H.	Hauptman-Woodward Medical Research Institute, Buffalo, NY, USA	An Objective Metric to Guide Background Correction and Interepretation of Small Angle X-ray Scattering Data
Śniechowska, Justyna	Center of Molecular and Macromolecular Studies, Polish Academy of Sciences, Lodz, Poland	A difficult art of crystallizing and characterizing elusive polymorphs of meloxicam
So, Iwata	Kyoto University, Kyoto, Japan	The structure of the ABC transporter PsaBC shows that bacterial manganese import is achieved by unique architectural features that are conserved across the kingdoms of life.
Soares, Alexei	Energy Sciences Directorate, NSLS II, Brookhaven National Laboratory, Upton, NY 11973-5000 USA	Using sound pulses to solve the crystal harvesting bottleneck
Soares, Alexei S	Brookhaven National Laboratory, P.O. Box 5000, Upton, NY, 11973-5000, USA	A simple technique to classify diffraction data from dynamic proteins according to individual polymorphs
Soares, Alexei S.	Center for BioMolecular Structure, NSLS-II, Brookhaven National Laboratory, Upton, NY 11973-5000, United States	Co-crystallization of hepatitis C virus NS3/4A inhibitors and SARS-CoV-2 main protease using high density acoustic droplet ejection (ADE)
Soares da Costa, T.P.	Department of Biochemistry and Genetics, La Trobe Institute for Molecular Science, La Trobe University, Melbourne, VIC, Australia	Understanding viral host interactions that modulate nuclear transport and innate immunity
Sobolev, Egor	EMBL, Hamburg, Germany	Macromolecular Model Building Over the Web
Sobolev, Oleg	Lawrence Berkeley National Laboratory, Berkeley, United States of America	Protein hydrogen bond parameters as a new validation tool
Sobrero, Cesar	Institut für Werkstofftechnik, Universität Kassel, 34125 Kassel, Germany	Effect of nano-SiC doping on the structure and superconducting properties of Mg (B_1-xC_x)₂
Socha, Pawel	University of Warsaw, Warsaw, Poland	Influence of steric hindrance on the hydrates formation. The case of 2,2,6,6-tetramethylpiperidine and 3,3,5,5-tetramethylmorpholine Presenter
Sofras, Christos	Paul Scherrer Institute, Villigen PSI, Switzerland	Tailoring the TRIP effect of austenitic stainless steels with selective laser melting
Soh, Jian-Rui	Institute of Physics, École Polytechnique Fédéral de Lausanne, Switzerland	Magnetic excitations and structure of the topological semimetal YbMnSb₂
Söhnel, Tilo	School of Chemical Sciences, University of Auckland, 23 Symonds Street, Auckland 1010, New Zealand; Macdiarmid Institute for Advanced Materials and Nanotechnology, Victoria University of Wellington, Wellington 6140, New Zealand	Memes: a new avenue for spreading crystallographic knowledge for the next generation Substitutional doping of trirutiline transition metal antimonates, MSb₂O₆
Sojková-Bartošová, Pavla	Institute of Parasitology, Biology Centre of Czech Academy of Sciences, Branišovská 1160/31, České Budějovice, 370 05, Czechia	Evolutionary upgrade of stefins for secretion in parasites
Sokolov, Dmitry	Max Planck Institute for Chemical Physics of Solids, Nöthnitzer Straße 40, 01187 Dresden, Germany	Peculiar commensurate spin density wave in CeAuSb₂ under uniaxial stress
Solana-Madruga, Elena	1CNRS, Université de Lille, Unité de Catalyse et chimie du Solid, 59652 Villeneuve d'Ascq Cedex, France	Complex magnetic structures in frustrated A-site manganites
Solano, Eduardo	Ghent University, Dept. of Solid State Sciences, COCOON Group, Krijgslaan 281/S1, 9000 Gent, Belgium; ALBA Synchrotron Light Source, SWEET-NCD Beamline, Carrer de la Llum 2-26, 08290 Cerdanyola del Vallès, Spain	In situ study of noble metal atomic layer deposition processes using grazing incidence small angle X-ray scattering
Soldatov, Alexander Vladimirovich	Southern federal university, Rostov on-Don, Russian Federation; The Smart Materials Research Institute, Southern Federal University, 344090 Rostov-on-Don, Russia; Southern Federal University, Rostov-on-Don, Russia; The Smart Materials Research Institute, Rostov-on-Don, Russian Federation	Facile synthesis of nano-structure LiCoPO₄@UiO-66 particles and its in-situ XAS, structural properties and electrochemical characterization for lithium batteries Analysis of pre-edge XANES spectra of Fe:SiO4 system by using machine learning methods. Analysis of XANES spectra for tektites using machine learning algorithms Detailed information about the core/shell/surface structure of palladium nanoparticles by combined in situ and operando X-ray absorption and diffraction data Evolution of Pd/CeO₂ surface morphology in situ monitored by FTIR spectroscopy Machine learning applied to operando XANES spectroscopy for Pd nanocatalysts X-ray absorption spectroscopy study of metal-organic frameworks functionalized by Pd: Formation and growth of Pd nanoparticles XAS and XRD analysis of active Pt and Pd sites in metal-organic framework UiO-67 Operando diagnostics of cathode materials based on novel sodium iron titanites Temperature and time-resolved XANES studies of novel valence tautomeric cobalt complex Ultraviolet-assisted synthesis and structural characterization of the Pd nanoparticles on the CeO₂ substrate
Soltau, Jakob	Georg-August-Universitaet Goettingen, Goettingen, Germany	Super-resolution X-ray holography Presenter
Sommer, Sanna	Center for Materials Crystallography, Department of Chemistry and iNano, Aarhus University, Aarhus C, Denmark	Group 13 precursor structures and their effect on oxide nanocrystal formation
Sondhauss, Peter	MAX IV Laboratory, Lund University, Lund, Sweden	MicroMAX – new opportunities in macromolecular crystallography
Song, Weixiao	University College London, London, United Kingdom	Fragment Based Drug Discovery of SARS-CoV-2 Main Protease Presenter
Song, Wen	Max Planck Institute for Plant Breeding Research, Köln, Germany	Structural mechanism of NAD+ cleavage by plant TIR domain
Song, Yang	Sorbonne Université, CNRS, Laboratoire de Chimie de la Matière Condensée de Paris (LCMCP), Paris, France.	Superhardness in boron carbide through nanostructuration
SORGHO, Brahima	University Joseph Ki-Zerbo, Ouagadougou, Burkina Faso	Geopolymers based on some clay from Burkina Faso : preparation and characterization
Sorigue, Damien	CEA, Saint Paul lez Durance, France	High-resolution structure and reaction cycle of Fatty Acid Photodecarboxylase: anatomy of a crime scene
Sorzano, Carlos O.S.	Spanish National Bioinformatics Institute (INB ELIXIR-ES). Biocomputing Unit, National Center for Biotechnology (CNB-CSIC). Instruct Image Processing Center	3DBionotes Covid-19 Edition
Sorzano, Carlos Oscar S.	CNB-CSIC, Madrid, Spain	FSC-Q: A method for quality analysis of cryoEM-derived models
Sosnowska, Izabela	Faculty of Physics, University of Warsaw, Pasteura 5 PL 02-093 Warsaw, Poland; University of Warsaw, Warsaw, Poland	Crystal symmetry for incommensurate helical and cycloidal modulations Magnetic modes compatible with the symmetry of crystals
Soto Navarro, Angy Katherin	Universidad Industrial de Santander, Bucaramanga, Colombia; Grupo de Investigación en Química Estructural (GIQUE), UIS Guatiguará, Km 2 vía Refugio, 681011, Piedecuesta, Colombia; Laboratorio de Química Orgánica y Biomolecular (LQOBio), Escuela de Química, Universidad Industrial de Santander	Synthesis and structural resolution by X-ray diffraction of polycrystalline samples of (E)-N-benzylidene-4-haloanilines
Sougrat, Rachid	King Abdullah University of Science and Technology, Core Labs, Thuwal 23955, Saudi Arabia	Spectral X-ray ptychography for the investigation of technical catalysts
SOUHASSOU, Mohamed	Université de Lorraine and CNRS, CRM2, BP 70239, 54506 Vandœuvre-lès-Nancy, France	Spin resolved charge density and wave function refinements: the Mollynx/MoPro software
Sousa Henriques, Margarida	Academy of Sciences of the Czech Republic, Prague, Czech Republic	Intermetallic compounds containing f-elements: synthesis of some of the compounds from the system R₂TGe₆ (R=Dy, Er; T=Ni, Cu, Pd)
Souvignier, Bernd		Introduction to session Presenter
Souvignier, Bernd	Radboud University, Faculty of Science, Mathematics and Computing Science, Institute for Mathematics, Astrophysics and Particle Physics. Postbus 9010, 6500 GL Nijmegen, The Netherlands.	Diffraction enhancement of symmetry and modular structures
Souza-Neto, Narcizo M.	Brazilian Synchrotron Light Laboratory (LNLS - CNPEM), Campinas, Brazil	EMA beamline status and its XRD prospects
Sovago, Ioana	The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge, CB1 2EZ, UK	Come for the drug, stay for the solvent! Presenter
Sozinov, Alexei	Material Physics Laboratory, LUT University, Yliopistonkatu 34, 53850 Lappeenranta, Finland	Hysteretic structural changes within five-layered modulated 10M martensites of Ni-Mn-Ga(-Fe)
Sozzani, Piero	University of Milano-Bicocca, Milano, Italy	Gas adsorption and separation: tuning the channel electrostatics for CO₂. Ultra-Fast Rotors and Light Emitting Ligands in Metal-Organic Frameworks
Sørensen, Daniel Risskov	Department of Chemistry & iNANO, Aarhus University, Denmark; MAX IV Laboratory, Lund University, Sweden	DanMAX – The new materials science beamline at MAX IV
Spaldin, Nicola A.	ETH Zurich, Zurich, Switzerland	Predicting ground state and metastable crystal structures using elemental and phonon mode
Spasojević-de Biré, Anne	SPMS, Centralesupelec, Gif sur Yvette, France	Analysis of the experimental parameters impacting Non-Photochemical Laser-Induced nucleation of glycine in water Presenter
Spasovski, Martin	School of Chemical Sciences, University of Auckland, 23 Symonds Street, Auckland 1010, New Zealand; Macdiarmid Institute for Advanced Materials and Nanotechnology, Victoria University of Wellington, Wellington 6140, New Zealand	Memes: a new avenue for spreading crystallographic knowledge for the next generation
Sperandio, Diogo Gabriel	Geology Department, Geosciences Institute, Federal University of Minas Gerais - UFMG, Belo Horizonte, MG, Brazil.	New insights about chemical etching for revelation of spontaneous fission tracks in garnets Presenter
Spingler, Bernhard	University of Zurich, Zurich, Switzerland	Crystallization of anionic small molecules with the help of a cation screen Presenter
Spink, Ian	Sigray, Inc., concord, United States of America	Holistically Optimized Laboratory XAS Systems
Spiwok, Vojtěch	University of Chemistry and Technology, 166 28 Prague, Czech Republic	Structural evidence for active site complementation and diverse oligomerization in two bacterial α-L-Fucosidases from the same organism
Sreedhara, Madhenahalli-Bhyrappa	Weizmann Institute of Science, Rehovot, Israel	Growth and stability of SmS-TaS₂ nanotubes studied by XAFS and DAFS methods.
Srinivasan, Vasundara	Universität Hamburg, Department of Chemistry, Institute of Biochemistry and Molecular Biology and Laboratory for Structural Biology of Infection and Inflammation, c/o DESY, 22607 Hamburg, Germany.	Structure of SARS-CoV-2 papain-like protease PLpro reveals a framework for antiviral inhibitor design Presenter
Srinivasu, Bindu	Laboratory of Molecular Bacteriology, Rega Institute, KU Leuven, Belgium	Structural evidence for the bleaching caused by oxygen in rsCherry
Srivastava, Anant Kumar	School of Physical Sciences, University of Kent, Canterbury, Kent, United Kingdom; Department of Materials Engineering, Indian Institute of Science (IISc), Bangalore, Karnataka, India	Enhancing the Chemical Flexibility of Hybrid Perovskites by Introducing Divalent Ligands
St. John, Sarah E	Purdue University, W Lafayette, United States of America	A structure-guided, taxonomic-based approach to the design of broad-spectrum coronavirus protease inhibitors
Staab, Lennart	Leipzig University, Faculty of Chemistry and Mineralogy, Leipzig, Germany	Binary beryllium pnictides: ordered and disordered coloring variants of the diamond structure
Stäb, Sabrina	Universität Hamburg, Germany	How machine learning can supplement traditional quality indicators - and the human eye: A case study
Stacey, Katryn J.	School of Chemistry and Molecular Biosciences, The University of Queensland, Brisbane, Queensland, Australia; Australian Infectious Diseases Research Centre, The University of Queensland, Brisbane, Queensland, Australia	MyD88 TIR domain higher-order assembly interactions revealed by microcrystal electron diffraction and serial femtosecond crystallography MyD88 TIR domain higher-order assembly interactions revealed by serial femtosecond crystallography
Stachowicz, Marcin	Institute of Geochemistry, Mineralogy and Petrology, Faculty of Geology, University of Warsaw, Żwirki i Wigury 93, Warsaw 02-089, Poland, Section 3.6; University of Warsaw, Warsaw, Poland	Charge density in fluorapatite, Ca₅(PO₄)₃F, from X-ray diffraction measurements on mineral and synthetic crystals Direct observation of pressure induced charge density redistribution at ions in zeolite, hsianghualite Presenter
Stachowski, Timothy R.	Hauptman-Woodward Medical Research Institute, Buffalo, NY, USA	An Objective Metric to Guide Background Correction and Interepretation of Small Angle X-ray Scattering Data
Stadnicka, Katarzyna M.	Faculty of Chemistry of Jagiellonian University in Kraków, Gronostajowa 2, 30-387 Kraków, Poland	Experimental and ab initio molecular dynamics study of hydrogen bond systems in selected crystals
Stagioni, Marco	Laboratory of Fisheries and Marine Biology at Fano, Department of Biological, Geological and Environmental Sciences, University of Bologna, Viale Adriatico 1/N, 61032, Fano, Italy	Ecomorphological, behavioural and physiological patterns in otoliths
Stagno, Jason R.	Center for Structural Biology, Centre for Cancer Research, National Cancer Institute, Frederick, MD-21702, USA.	Solid-solid phase transition in adenine riboswitch crystals driven by large conformational changes induced by ligand Presenter
Stalke, Dietmar		Introduction to session Presenter
Stalke, Dietmar	Institut für Anorganische Chemie, Georg-August-Universität Göttingen, 37077 Göttingen, Germany	Ducks in space groups! Students grasping 3D-arrangement of symmetry elements with hands-on models
Stam, Danny	Technobis Crystallization Systems B.V., Alkmaar, The Netherlands; ELDICO Scientific AG, 5234 Villigen, Switzerland	The Future of Co-crystallisation: A New Workflow Based on AI Predictions, the Crystal16 Platform and Electron Diffraction Presenter
Standfuss, Joerg	Paul Scherrer Institut, Forschungstrasse 111, Villigen, 5232, Switzerland	Pink-beam serial femtosecond crystallography for accurate structure factor determination at an X-ray free electron laser
Stani, Chiaramaria	CERIC-ERIC, Basovizza, Trieste, Italy	A multidisciplinary study unveils the nature of a Roman ink of the I century AD Presenter
Stani, Chiaramaria	Elettra - Sincrotrone Trieste, ss 14, km 163.5, 34149 Basovizza, Trieste Italy.	XAS, IR and XRD analysis for structural characterization of rare minerals: new occurrence of demantoid garnets in Sa Spinarbedda mine (Sardinia – Italy)
Stanković, Ivana M.	Institute of Chemistry, Technology and Metallurgy, University of Belgrade, Belgrade, Serbia	Study of noncovalent interactions using crystal structure data in the Cambridge Structural Database How flexible is the water molecule structure? Cambridge Structural Database and ab initio calculations study.
Stanley, Alexandra	Rigaku Europe SE, Frankfurt, Germany	Using Zoom Webinar to Teach Advanced Topics in Crystallography
Starchikov, Sergey	Shubnikov Institute of Crystallography of FSRC “Crystallography and Photonics” RAS, 119333, Moscow, Russia; Shubnikov Institute of Crystallography of Federal Scientific Research Centre “Crystallography and Photonics” of Russian Academy of Sciences, Moscow, Russian Federation	Crystal structure and Mössbauer studies of gallium iron borate single crystals Hyperfine interactions of ⁵⁷Fe nuclei in a weak ferromagnet FeBO₃
Stark, Holger	Max-Planck-Institute for biophysical chemistry, Goettingen, Germany	Atomic resolution structure determination by cryo-EM – where are the limits? Presenter
Stash, Adam I.	A. N. Nesmeyanov Institute of Organoelement Compounds, RAS, 28 Vavilova str, 119991 Moscow, Russia	Charge density distribution of API in crystals and ligand-receptor complexes
Staskawicz, Brian	Department of Plant and Microbial Biology, University of California, Berkeley, CA 94720 USA; Innovative Genomics Institute, University of California, Berkeley, CA 94720 USA.	Structure of the activated ROQ1 resistosome directly recognizing the pathogen effector XopQ
Stawski, Tomasz M.	BAM Berlin (Bundesanstalt für Materialforschung und -prüfung), Berlin, Germany	Crystallization and nucleation study of transition metal struvite and related compounds
Stec, Przemyslaw	Rigaku Polska Sp. z o.o., Wrocław Poland	Introducing the XtaLAB Synergy Flow
Štefanič, Saša	Institute of Parasitology, University of Zurich, Winterthurerstrasse, Zurich, CH-8057, Switzerland	Evolutionary upgrade of stefins for secretion in parasites
Stegmann, Niklas	Max-Planck-Institut für Kohlenforschung, Heterogeneous Catalysis, Kaiser-Wilhelm-Platz 1 45470 Mülheim, Germany	Ab initio structure determination of two new titanium phosphates synthesized via molten salt synthesis.
Stein, Robin S.	McGill University, Montreal, Canada	Monitoring polymorphic transition of a cocrystal to a salt using time-resolved X-ray powder diffraction and solid-state nuclear magnetic resonance spectroscopy
Steiner, Roberto A.	King's College London, London, United Kingdom	Modelling and refinement of hydrogens: new developments in CCP4
Steinfeld, Gunther	ELDICO Scientific AG, 5234 Villigen, Switzerland	3D Electron diffraction for the discovery of new crystal forms of APIs 3D electron diffraction: a dedicated device for structural elucidation of nanocrystalline particles An electron diffractometer : A novel device for electron crystallography experiments Presenter The ´Why´ and ´How´ of a Dedicated Electron Diffractometer The Future of Co-crystallisation: A New Workflow Based on AI Predictions, the Crystal16 Platform and Electron Diffraction
Stellhorn, Jens R.	Hiroshima University, Hiroshima, Japan; Dept. of Applied Chemistry, Hiroshima University, Higashi-Hiroshima 739-8527, Japan	Structure of sustainable lead-free low-melting vanadate glass Atomic resolution holography for characterizing the local structure in quasicrystals Presenter
Stenning, Gavin B.G.	ISIS Facility, STFC Rutherford Appleton Laboratory, Didcot, UK	Exploring the magnetocaloric effect in the Ln(HCO₂)(C₂O₄) family of Metal-Organic Frameworks
Sternberg, Michael J.E.	Imperial College London, United Kingdom	Le mieux est l\'enemi du bon; homology modelling with Phyre2 in a deep learning world
Stetsenko, Artem	Groningen Biomolecular Sciences and Biotechnology Institute (GBB), University of Groningen, Groningen, the Netherlands	Structure of the 80S ribosome from Candida albicans revealed by integrative structural biology approach
Steudel, Annett	FIZ Karlsruhe - Leibniz-Institut für Informationsinfrastruktur, Eggenstein-Leopoldshafen, Germany	Behind the scenes - data processing and quality assurance for the ICSD Presenter
Stevenson, Michael G	University of Rostock, Rostock, Germany	Phase Changes in Dynamically Compressed Water Presenter
Stewart, Andrew Alexander		Introduction to session Presenter
Stewart, Nichole	Department of Chemistry and Biochemistry, University of Notre Dame, Notre Dame, Indiana, USA	Structural and mechanistic studies on carbapenem-hydrolysing class D serine β-lactamases leading to improved inhibitor design
Stöger, Berthold		Introduction to session Presenter
Stokes, Harold T	Brigham Young University, Physics & Astronomy, Provo, Utah, USA	Advances in the application of magnetic and non-magnetic superspace-group symmetry
Stokes, Harold T	Brigham Young University, Provo, United States of America	The science of symmetry breaking: A personal journey Presenter
Storici, Paola	Protein Facility, Elettra Sincrotrone Trieste S.C.p.A, Italy	Structural characterization of the PTG and PTG/PP1 complex
Storm, Selina Lea Sophie		Introduction to session Presenter
Storm, Selina Lea Sophie	Diamond Light Source, Didcot, United Kingdom; EMBL Hamburg, Germany, Germany	Optimised high energy data collection in protein crystallography with a CdTe based detector Presenter
Storozhuk, Darina	Photon Science Division, Deutsches Elektronen-Synchrotron DESY, Hamburg, 22607, Germany	Photo-induced electron transfer in Pyrene-(CH₂)₂-N,N\'-Dimethylaniline: Time-resolved pink Laue X-ray diffraction studies on crystalline polymorphs.
Storozhuk, Darina	Photon Science - Structural Dynamics in Chemical Systems, Deutsches Elektronen-Synchrotron DESY, Hamburg, 22607, Germany	Crystallographic studies of the spin state transition of three Fe(II) metallogrids: thermal vs ultra-fast photoswitching
Stoudt, Mark R.	Material Measurement Laboratory, National Institute of Standards and Technology, Gaithersburg, MD 20899, USA	Breaking Bad: Towards Certifiable Additively Manufactured Alloys Using Post-Build Heat Treatment
Støttrup Larsen, Anders	Department of Pharmacy, University of Copenhagen, Universitetsparken 2, 2100 København Ø, Denmark	Determination of the crystal structure of magnesium stearate hydrate using micrometre size single crystals
Straka, Ladislav	Institute of Physics of the Czech Academy of Sciences, Na Slovance 1999/2, 18221 Prague 8, Czech Republic; Institute of Physics of Czech Academy of Sciences, Praha, Czech Republic; Faculty of Mathematics and Physics, Charles University, Ke Karlovu 5, 12116 Prague 2, Czech Republic	Hysteretic structural changes within five-layered modulated 10M martensites of Ni-Mn-Ga(-Fe) Ni₂MnGa shape memory alloy studied by x-ray diffraction measured in-situ in tension Intermartensitic transformation between modulated structures in Heusler Ni-Mn-Ga(-Fe) single crystals
Stránský, Jan	Institute of Biotechnlogy, CAS, Vestec u Prahy, Czech Republic	Employing high-end X-ray technologies for laboratory structural biology in Centre of Molecular Structure Presenter
Stránský, Jan	Institute of Biotechnology of the Czech Academy of Sciences, 25250 Vestec, Czech Republic	Structural evidence for active site complementation and diverse oligomerization in two bacterial α-L-Fucosidases from the same organism Finding the optimal resolution cutoff with PAIREF
Stráský, Josef	Charles University, Faculty of Matehematics and Physics, Prague 2, Czech Republic	Phase Transformations in Ti-Nb-Zr-Ta-O Beta Titanium Alloys with High Oxygen and Reduced Nb and Ta Content
Stratford, Joshua	School of Chemistry, University of Birmingham, UK	Exploring the formation of Hf metal-organic frameworks
Streit, Martin	University of Wuerzburg, Wuerzburg, Germany	Investigating the redox cycle of tryparedoxin at ultra-high resolution
Strempfer, Joerg	Argonne National Laboratory, Lemont, United States of America	Possibilities at the Polar beamline at APS Presenter
Strickland, Peter Raymond	International Union of Crystallography, Chester, United Kingdom	What literature papers are related to my diffraction dataset? Pydatarecognition - a web project of the IUCr Journals and Columbia University
Strkalj, Nives	Department of Materials Science, ETH Zurich, Zurich, Switzerland; Department of Materials Science and Metallurgy, Cambridge University, United Kingdom	Studying local order in ferroelectric oxide superlattices with three-dimensional diffuse X-ray scattering
Strobl, Markus	Paul-Scherrer Institute, Switzerland; Paul Scherrer Institute, Villigen PSI, Switzerland	Trindex - 3D Grain Orientation Mapping with Neutron Imaging Tailoring the TRIP effect of austenitic stainless steels with selective laser melting
Strohm, Cornelius	Deutsches Elektronen-Synchrotron DESY	Towards higher densities of matter: ultra-high pre-compression in shock dynamic experiments
Stroud, David	Department of Biochemistry and Molecular Biology and The Bio21 Molecular Science and Biotechnology Institute, The University of Melbourne, Parkville, Victoria 3010, Australia	Structural characterisation of mitochondrial complex IV assembly factors
Stroud, David A	University of Melbourne, Melbourne, Australia	Unravelling the molecular architecture of the Commander assembly
Strugatsky, Mark	Physics and Technology Institute, V.I. Vernadsky Crimean Federal University, 295007, Simferopol, Russia	Crystal structure and Mössbauer studies of gallium iron borate single crystals Hyperfine interactions of ⁵⁷Fe nuclei in a weak ferromagnet FeBO₃
Strungaru, Nicolae		Introduction to session Presenter
Strunz, Pavel	Nuclear Physics Institute ASCR, v.v.i., Řež, Czech Republic	High-resolution neutron three axis diffractometer for studies of elastic and plastic deformation of polycrystalline materials Investigations of the precipitation microstructure in the alloys, hard metal composites, and powders using SANS Microstrain and texture in rotary swaged W-Ni-Co pseudoalloy Presenter
Strynadka, Natalie	UBC, Vancouver, Canada	Hybrid structural methods to probe atomic features of the Type III Secretion Injectisome of Pathogenic Bacteria Presenter
Strzalka, Radoslaw	AGH University of Science and Technology, Krakow, Poland	The d-AlCuRh stability – the proof of the random-tiling hypothesis by the distribution moments analysis A novel, statistical approach for structure determination of modulated pathogenesis-related protein (Hyp-1) complex with ANS
Strzałka, Radosław	AGH University of Science and Technology, Krakow, Poland	High-temperature structural studies of d-AlCuRh – phasonic stabilization Presenter
Stuerzer, Tobias	Bruker AXS GmbH, Karlsruhe, Germany	Chaperone Compounds for Co-crystallization of Organics Pushing the Limits of Microfocus X-Ray Sealed Tube Sources for Crystallography
Sturm, Marina	Deutsches Elektronen-Synchrotron DESY, Hamburg, Germany	Total scattering at grazing incidence to study real thin film systems at variable temperature
Su, An-Chung	National Tsing Hua University Department of Chemical Engineering; Department of Chemical Engineering, National Tsing Hua University, Hsinchu 30013, Taiwan	Densely Packed UV-Visible Light Responsive Photocatalytic Pairs in Hexagonally Arrayed Silicate Nanochannels for Hydrogen Production Probing Protein Structures in Solution by Molecular Dynamics Simulation and Small-Angle X-ray Scattering
Su, An-Chung	National Synchrotron Radiation Research Center, Hsinchu,Taiwan	Revealing the Metal-Ligand Coordination effects on the Structure modifications for Balanced Tensile Modulus and Self-Healing of Polyurethane Films
Su, Chun-Jen	National Synchrotron Radiation Research Center, Hsinchu, Taiwan	Stoichiometric unfolding of bovine serum albumin by surfactant, as revealed from HPLC/SAXS with online observation of UV-Vis absorption and refractive index. Revealing the Metal-Ligand Coordination effects on the Structure modifications for Balanced Tensile Modulus and Self-Healing of Polyurethane Films A New Biological Small- and Wide-Angle X-ray Scattering Beamline Featured in High Flux, USAXS, and Microbeam at Taiwan Photon Source
Su, Chun-Jen	National Synchrotron Radiation Research Center, Hsinchu Science Park, Hsinchu 30076, Taiwan	Data treatment and data storage at the BioSAXS beamline TPS 13A SAXS-revealed nanostructures of poly(ethylene glycol)-grafted phospholipid vescicles
Su, Hao	School of Physical Science and Technology, ShanghaiTech University, China	Magnetic excitations and structure of the topological semimetal YbMnSb₂
Su, Hong	University of Cape Town, Cape Town, South Africa	Separation of Lutidine Isomers by Selective Enclathration
Su, Yixi	Jülich Centre for Neutron Science at Heinz Maier-Leibnitz Zentrum, Forschungszentrum Jülich GmbH, 85747 Garching, Germany	Development of a high pressure option for neutron scattering experiments at low temperatures and high magnetic fields at the MLZ
Su, Yu	International Center for Materials Nanoarchitectonics (WPI-MANA), National Institute for Materials Science, Tsukuba, Ibaraki 305-0044, Japan;	Pb₂NiOsO₆: antiferromagnetic order breaks inversion symmetry in high pressure perovskite
Suarez, Sebastian	Buenos Aires University, CABA, Argentina.	In situ photoswitching of spirorhodamines isomers in solid-state Presenter
Suarez, Sebastian A.	University of Buenos Aires, CABA, Argentine	Synthesis & crystallographic, spectroscopic and computational characterization of O-R substituents effects on the torsional angle of 3,3\',4,4\' substituted biphenyls
Subbotin, Ilya A.	NRC “Kurchatov Institute” – Institute for Theoretical and Experimental Physics, Moscow, Russia	Conceptual design of a scattering/diffraction beamline for the Russian synchrotron Ultimate Source for Synchrotron Radiation
Subramanian, Priya	Mathematical Institute, University of Oxford, Oxford OX2 6GG, United Kingdom	How to determine thermodynamically stable soft matter quasicrystals efficiently? Presenter
Sudzinová, Petra	Institute of Microbiology of the Czech Academy of Sciences, Prague, Czech Republic	Deciphering the role of unique bacterial transcription-associated factor HelD.
Suescun, Leopoldo	Cryssmat-Lab, DETEMA, Facultad de Química, Universidad de la República, Av. Gral Flores 2124, Montevideo 11800, Uruguay; Facultad de Química, Universidad de la República, Montevideo , Uruguay	Stacking differences and similarities between a new and two old lapachol polymorphs Synthesis, characterization of high-temperature properties and evaluation of REBa2Cu3O6+δ (RE = La, Nd and Y) as cathode for Intermediate Temperature Solid Oxide Fuel Cells. Teaching crystallographic symmetry in Latin America. A 10-year review and perspectives.
Suga, Hiroaki	Department of Chemistry, Graduate School of Science, the University of Tokyo, 7-3-1 Hongo, Bunkyo-Ku, Tokyo 113-0033, Japan	Inhibiting, stabilising and probing the function of the Retromer endosomal trafficking complex through the novel macrocyclic peptides
Sugawara, Kento	Synchrotron Radiation Research Center, Kansai Photon Science Institute, Quantum Beam Science Research Directorate, National Institutes for Quantum and Radiological Science and Technology (QST), SPring-8, 1-1-1 Kouto, Sayo, Hyogo 679-5148, Japan	Development and improvement of Bragg coherent diffraction imaging for expanding observable particle-size range
Sugimoto, Kunihisa	Japan Synchrotron Radiation Research Institute (JASRI), SPring-8, Sayo, Hyogo, 679-5198, Japan; Institute for Integrated Cell-Material Sciences, Kyoto University, Kyoto 606-8501, Japan,; JASRI SPring-8, Hyogo, Japan; Research and Utilization Division, Japan Synchrotron Radiation Research Institute, Sayo, Hyogo 679-5198, Japan; Institute for Integrated Cell-Material Sciences (iCeMS), Kyoto University, Yoshida-Ushinomiya-cho, Sakyo-ku, Kyoto 606-8501, Japan	Development of high-speed capillary spinner cell for in-situ powder diffraction under gas pressure control Suppression mechanism of the ferroelectric polarization in multiferroic tetragonal perovskiteSr_1/2Ba_1/2MnO₃ Time resolved structure analysis of vibrating gallium phosphate under alternating electric field
Sugimoto, Takashi	RIKEN SPring-8 Center, Hyogo, Japan; Japan Synchrotron Radiation Research Institute, Hyogo, Japan	Development of an on-the-fly data processing with information-lossless compression for CITIUS detectors at SPring-8
Sugishima, Masakazu	Kurume University School of Medicine, Kurume, Japan	Domain movements of NADPH–cytochrome P450 oxidoreductase (CPR) are required for the smooth electron transfer from CPR to heme–heme oxygenase-1 (HO-1) complex Presenter
Sugiyama, Kazumasa	Institute for Materials Research, Tohoku University, Sendai, Japan	Reinvestigation of site-disorder in dense ice by in-situ neutron diffraction techniques
Sugiyama, Masaaki		Introduction to session Presenter
Sugiyama, Masaaki	Institute for Integrated Radiation and Nuclear Science, Kyoto University, Osaka, Japan	Structural analysis of antibody complexes by inverse contrast-matching small-angle neutron scattering combined with size exclusion chromatography (SEC-iCM-SANS) Dynamics of multi-domain protein ER-60 revealed by small angle X-ray scattering data and molecular dynamics simulations Establishment of basic techniques related to protein sample preparation for neutron scattering Subunit dynamics in alpha-crystallin through deuteration-assisted small-angle neutron scattering AUC-SAS: Integrated analysis of biomacromolecular structure with analytical ultracentrifugation (AUC) and small-angle scattering (SAS)
Sugiyama, Shigeru	Faculty of Science & Technology, Kochi University, Kochi, Japan	Growth of protein crystals in high-strength hydrogels with the dialysis membrane Presenter
Šulcová, Lucie	University of Chemistry and Technology in Prague, Praha, Czech Republic	Phase structure of metallothermally reduced deep-sea concretion
Sumby, Christopher		Introduction to session Presenter
SUMBY, Christopher	Department of Chemistry, The University of Adelaide, Adelaide, Australia	Solid-state isolation of reactive complexes in a metal-organic framework matrix Presenter
Sun, Junliang		Introduction to session Presenter
Sun, Junliang	Peking University, Beijing, China, People's Republic of	Structure determination of nanocrystals
Sun, Wenhao	University of Michigan, Ann Arbor, United States of America	Unsupervised Knowledge Discovery in ‘Big’ Materials Data
sun, xiaomei	Faculty of Advanced Life Science, Hokkaido university	Structural insights into the phlorotannin binding of EHEP and akuBGL for producing biofuel from brown algae Presenter
Sundaram, Arunkumar	University of Chicago, Chicago, United States of America	An ER translocon for multi-pass membrane protein biogenesis
Sunil, Janaky	Chemistry and Physics of Materials Unit, Jawaharlal Nehru Centre for Advanced Scientific Research, Bengaluru 560064, India	Organic eutectics: characterization, microstructural evolution, and properties.
Sura, Sumita	Homi Bhabha national institute Mumbai India	Exploring the high pressure bcc alloy phase of topological Insulator PbBi₄Te₇: synchrotron x-ray diffraction measurement and DFT simulations Presenter
SURESH, SUGANYA	Laboratory of Biocrystallography and Computational Molecular Biology Department of Physics, Periyar University, Salem-636 011, India	Understanding the role of non-covalent interactions in the acridine with different acids of salt molecules Presenter
Susini, Jean	Synchrotron SOLEIL, Gif sur Yvette, France	The ultra-low emittance synchrotron storage rings: a new paradigm for matter characterization.
Sutter, Eli	University of Nebraska-Lincoln, Lincoln, United States of America	1D Nanowires of 2D Layered Materials: A New Frontier in Nanomaterials Presenter
Sutter, Peter	University of Nebraska-Lincoln, Lincoln, United States of America	1D Nanowires of 2D Layered Materials: A New Frontier in Nanomaterials
Sutula, Szymon Marcin	Department of Chemistry, University of Warsaw, Pasteura 1, 02093 Warszawa, Poland	In search of anharmonic motion of H-atoms Presenter
Sutuła, Szymon	University of Warsaw, Biological and Chemical Research Centre, Core Facility for Crystallography and Biophysics, 101 Zwirki i Wigury, 02-089 Warsaw, Poland	Core Facility for Crystallographic and Biophysical Research to support the development of medicinal products
Suzuki, Kosuke	Gunma University, Kiryu, Japan	Redox oscillations in 18650-type lithium-ion cell revealed by in-operando Compton scattering imaging Presenter
Suzuki, Shunta	Gunma University, Kiryu, Japan	Redox oscillations in 18650-type lithium-ion cell revealed by in-operando Compton scattering imaging
Švarcová, Silvie	Institute of Inorganic Chemistry of the Czech Academy of Sciences, ALMA Laboratory, Husinec-Řež 1001, 250 68 Husinec-Řež, Prague, Czech Republic	Characterization of metal carboxylates relevant for degradation of oil paintings by complementary XRPD and ssNMR XRPD as a tool for the study of pigment-binder interactions: from metal formates to long-chain carboxylates
Švecová, Leona	Institute of Biotechnology of the Czech Academy of Sciences, v.v.i., Průmyslová 595, 252 50 Vestec, Czech Republic; Faculty of Nuclear Sciences and Physical Engineering, Czech Technical University in Prague, Břehová 7, 115 19 Prague 1, Czech Republic	FAD-dependent oxidoreductase from Chaetomium thermophilum: Crystallographic fragment screening-based identification of putative substrates Presenter
Svensson Grape, Erik	Stockholm University, Stockholm, Sweden	Electron diffraction for the promotion of stable and green metal-organic frameworks
Svergun, Dmitri	EMBL Hamburg c/o DESY, Notkestrasse 85, 22607 Hamburg, Germany	Anomalous small-angle X-ray scattering on biological macromolecules at the P12 beamline of EMBL-Hamburg
Svergun, Dmitri I.	EMBL Hamburg, Hamburg, Germany; European Molecular Biology Laboratory (EMBL), DESY Hamburg, Germany	A pipeline for time-resolved small-angle X-ray scattering data analysis on amyloid fibrils formation in solution Chemical biology and structural studies on the mechanism of regulation of phosphoinositide-dependent protein kinase 1 (PDK1)
Svergun, Dmitry		Introduction to session Presenter
Svetogorov, Roman	NRC Kurchatov Institute, Moscow, Russian Federation	High-resolution synchrotron powder diffraction with the use of scanning 2D detector Presenter X-ray structural analysis of crystalline materials at the XSA/Belok beamline at synchrotron radiation source of the Kurchatov institite
Švorec, Jozef	Slovak University of Technology, Bratislava, Slovak Republic	Hirshfeld Atom Refinement of crystal structure and Hirshfeld surface analysis of five copper(II) fenamate complexes with N,N-diethylnicotinamide.
Swain, Diptikanta	Indian Institute of Science, Bangalore, India, Bangalore, India	Investigation of structural phase transitions and superionic property of a Vanthoffite mineral, Na₆Co(SO₄)₄
Sweet, Rober M	Brookhaven National Laboratory, P.O. Box 5000, Upton, NY, 11973-5000, USA	A simple technique to classify diffraction data from dynamic proteins according to individual polymorphs
Swepston, Paul N.	Rigaku Americas Corp., The Woodlands, TX, USA	Using Zoom Webinar to Teach Advanced Topics in Crystallography
Swift, Damian	Lawrence Livermore National Laboratory, Livermore, United States of America	Investigations of the high-pressure, high-temperature behaviour of Au using laser-driven dynamic compression
Sycz, Gabriela	Fundación Instituto Leloir, IIBBA-CONICET, Buenos Aires, Argentina	Crystal structure of the C24 protein from the Antarctic bacterium Bizionia argentinensis JUB59, a putative long tail fiber receptor-binding tip from a novel temperate bacteriophage
Sýkora, Michal	Institute of Molecular Genetics of the Czech Academy of Sciences, Prague, Czech Republic	Deciphering the role of unique bacterial transcription-associated factor HelD.
Sypko, Aleksandra	Biological and Chemical Research Centre, Department of Chemistry, University of Warsaw, Warszawa, Poland	Moving quantum crystallography from sub-atomic XRD to near-atomic 3D ED
Szabo, Attila	ISIS Neutron and Muon Source, UK; Department of Physics, University of Oxford, UK	Complex A-site magnetism in quadruple perovskite materials
Szarejko, Dariusz Krzysztof	Departmen of Chemistry, Warsaw University, Warszawa, Poland	Seed-skewness algorithm for x-ray diffraction signal detection in the time-resolved synchrotron Laue photocrystallography Presenter
Székely, Edit	Department of Chemical and Environmental Process Engineering, Faculty of Chemical Technology and Biotechnology, Budapest University of Technology and Economics, Budapest, Hungary	A bug in enantiomer separation: double salt formation – diastereomeric and double salt structures of 1-cyclohexylethylammonium 2- and 4-chloromandelate
Székely, György	4Advanced Membranes and Porous Materials Center, Physical Science and Engineering Division (PSE), King Abdullah University of Science and Technology (KAUST) Thuwal, 23955–6900, Saudi Arabia; Department of Chemical Engineering and Analytical Science, The University of Manchester, United Kingdom	Resolving P-stereogenic enantiomers at nonambient-conditions

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Privacy Statement · Conference: IUCr 2021 | August 14 - 22, 2021 | Prague, Czech Republic

XXV General Assembly and Congress of the International Union of Crystallography - IUCr 2021

August 14 - 22, 2021 | Prague, Czech Republic

Index of Authors

XXV General Assembly and Congress of the
International Union of Crystallography - IUCr 2021