XXV General Assembly and Congress of the
International Union of Crystallography - IUCr 2021
August 14 - 22, 2021 | Prague, Czech Republic
Conference Agenda
Overview and details of the sessions of this conference. Please select a date or location to show only sessions at that day or location. Please select a single session for detailed view (with abstracts and downloads if available).
Please note that all times are shown in the time zone of the conference. The current conference time is: 1st Nov 2024, 01:58:59am CET
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Session Overview |
| Date: Wednesday, 11/Aug/2021 | |
| 9:00am - 6:30pm | School - Electron: Electron Crystallography School Location: virtual Session Chair: Xiaodong Zou Session Chair: Louisa Meshi Session Chair: Lukáš Palatinus Website - virtual Videos I: Introduction -
Kolb: ADT -
Hovmöller: RED Videos II: Mugnaiolli: From precession... - Abrahams: Continuos rotation... - Yonekura: 3D ED ... Videos III: Hadermann: X-ray and electron... - Hovmoller: Symmetry... - Meshi: Unit cell ... Videos IV: Xu: Sample preparation... - Nannenga: Data collection... - Willhammar: cRed data collection ... Videos V: Gonen: MicroEd... - Sponsors |
| 9:00am - 6:30pm | Workshop - Data: When should small molecule crystallographers publish raw diffraction data? Location: virtual Session Chair: Amy Sarjeant Session Chair: Simon John Coles Website - virtual |
| Date: Friday, 13/Aug/2021 | |
| 8:30am - 4:30pm | School - Aperiodic 2: Workshop on Aperiodic and Magnetic Structure for Beginners Location: Institute of Physics, Czech Academy of Sciences Session Chair: Václav Petříček Session Chair: Margarida Henriques |
| 8:30am - 4:30pm | Workshop - Olex: Olex2 workshop Location: virtual Session Chair: Horst Puschmann |
| 9:00am - 5:00pm | School - Electron 3: Electron Crystallography School Location: virtual Session Chair: Xiaodong Zou Session Chair: Louisa Meshi Session Chair: Lukáš Palatinus Videos I: Murshudov: Refinement of macromolecular... -
Yamashita: Coot... Videos III: Palatinus: PETS and Jana 2006... - Palatinus: Dynamic refinement... Videos IV: Afonine: Phenix... - Afonine: Phenix-sof demo... QA. |
| 9:00am - 5:00pm | Workshop - ICDD: ICDD workshop Location: virtual Session Chair: Thomas Nelson Blanton Session Chair: Jose Miguel Delgado Virtual workshop |
| 12:30pm - 5:00pm | Workshop - MSB: Methods of Structural Biology Location: Biocev Session Chair: Jan Dohnalek Session Chair: Jan Stránský |
| Date: Saturday, 14/Aug/2021 | |
| 9:00am - 1:00pm | Workshop - APEX: APEX4 Workshop (Bruker) Location: virtual Website - virtual |
| 9:00am - 3:00pm | Workshop - MX: MX Raw image data and metadata, formats and validation Location: virtual |
| 9:00am - 4:30pm | Workshop - WDQA: Data quality assesment Location: 221-2 Session Chair: Julian Henn |
| 2:00pm - 5:00pm | School - Electron 4: Electron Crystallography School Location: Club H Session Chair: Xiaodong Zou Session Chair: Louisa Meshi Session Chair: Lukáš Palatinus |
| 5:30pm - 6:30pm | Opening: Opening ceremony Session Chair: Ivana Kuta Smatanova Session Chair: Pavlína Řezáčová |
| 6:30pm - 7:00pm | Opening music: Music Ensemble Website |
| 7:00pm - 7:50pm | Ewald: Ewald prize lecture Session Chair: Suzanna Ward Olga Kennard |
| 8:00pm - 10:00pm | Welcome: Welcome drink and refreshment Location: Exhibition and poster area |
| Date: Sunday, 15/Aug/2021 | |
| 9:00am - 9:50am | KN-1: Quantum Crystallography: Past, Present, and Future Location: Terrace 2A Session Chair: Krzysztof Wozniak Dylan Jayatilaka |
| 9:00am - 9:50am | KN-2: The symbiosis of cryo-EM and X-ray crystallography in structure determination of large macromolecular systems Location: Terrace 2B Session Chair: Marcin Nowotny Holger Stark |
| 9:00am - 9:50am | KN-3: High Pressure Crystallography Unlimited Location: Club A Session Chair: Arthur Haozhe Liu Leonid Dubrovinsky |
| 9:50am - 10:20am | Morning break 1: Exhibition, posters, coffee/tea Location: Exhibition and poster area |
| 10:20am - 12:45pm | MS-1: Structural bioinformatics Location: Club B Session Chair: Janusz Marek Bujnicki Session Chair: Jiri Cerny Invited: Zhichao Miao (UK) |
| 10:20am - 12:45pm | MS-2: Validation of cryoEM structures and maps Location: Club A Session Chair: Jose-Maria Carazo Session Chair: Elena Orlova Invited: Florence Tama (Japan), Pavel Afonine (USA), G. Kleywegt (Germany) |
| 10:20am - 12:45pm | MS-3: Crystallographic approaches for designing new framework materials (including post-synthetic modification) Location: 223-4 Session Chair: Yue-Biao Zhang Session Chair: Sergei Alexandrovich Sapchenko |
| 10:20am - 12:45pm | MS-4: Quantum crystallography challenges and newest accomplishments Location: Club C Session Chair: PIERO MACCHI Session Chair: Dietmar Stalke Invited: Alessandro Genoni (France), Nicolas Claiser (France) |
| 10:20am - 12:45pm | MS-5a: Crystal structure prediction Location: Terrace 2A Session Chair: Qiang Zhu Invited: Ivan Kruglov (Russia), Graeme Day (UK) |
| 10:20am - 12:45pm | MS-6: Application of electron crystallography to functional materials Location: Terrace 2B Session Chair: Holger Klein Session Chair: Karla Balzuweit Invited: Mauro Gemmi (Italy), Maria Roslova (Germany) |
| 10:20am - 12:45pm | MS-7: High troughput vs. careful planning: How to get the best data? Location: Club H Session Chair: John Richard Helliwell Session Chair: Selina Lea Sophie Storm Invited: Danny Axford (UK), Aina Cohen (USA) |
| 10:20am - 12:45pm | MS-8: Social media and new frontiers for spreading crystallographic Location: Club D Session Chair: Andrea Ienco Session Chair: Helen Maynard-Casely Invited: Delphine Chenevier (France), Rhiannon Morris (Australia) |
| 10:20am - 12:45pm | SMS-1: Session in the memory of An-Pang Tsai: from quasicrystals to catalysis Location: 221-2 Session Chair: Marc de Boissieu Session Chair: Yasushi Ishii |
| 12:45pm - 2:45pm | ECA-0: ECA EC meeting Session Chair: Udo Heinemann Session Chair: Arie van der Lee ECA EC meeting |
| 12:45pm - 2:45pm | Lunch 1: Exhibition, posters, lunches Location: Exhibition and poster area |
| 1:30pm - 2:30pm | CS-1: Commercial session: Bruker / Incoatec Location: Terrace 2A Session Chair: Martin Adam Session Chair: Joerg Wiesmann 60 min company presentation |
| 2:45pm - 3:45pm | MS-5b: Crystal structure prediction Location: 223-4 Session Chair: Qiang Zhu Session Chair: Rajeev Ahuja |
| 2:45pm - 5:10pm | MS-09: Structure guided drug design and antibiotic resistance targets Location: Club A Session Chair: Begoña Heras Session Chair: Anton V. Zavialov Invited: Vibha Gupta (India), Jade Forwood (Australia) |
| 2:45pm - 5:10pm | MS-10: Structural biology of eukaryotic immune systems Location: Club B Session Chair: Bostjan Kobe Session Chair: Savvas Savvides Invited: Tsan Sam Xiao (USA), Raul Olivier Martin (USA), Wen Song (Germany) |
| 2:45pm - 5:10pm | MS-11: Ab initio powder structure analysis for polymorphism and phase transformation studies with pharmaceutical applications Location: Club D Session Chair: Martin U. Schmidt Session Chair: Fabia Gozzo Invited: Kenneth Harris (UK), Jim Kaduk (USA) |
| 2:45pm - 5:10pm | MS-12: Quantum crystallographic studies on intra/inter-molecular interactions Location: Club H Session Chair: Anna Maria Makal Session Chair: Chérif F. Matta Invited: Jacob Overgaard (Denmark), Benoit Guillot (France) |
| 2:45pm - 5:10pm | MS-13: Porous framework materials for gas adsorption/separation Location: Club C Session Chair: Angiolina Comotti Session Chair: Ryotaro Matsuda Invited: Michael Zaworotko (Ireland) , Catharine Esterhuysen (South Africa) |
| 2:45pm - 5:10pm | MS-14: Perovskites Location: Terrace 2B Session Chair: Chris Ling Session Chair: Philip Lightfoot Invited: James Rondinelli (USA), Joke Hadermann (Belgium) |
| 2:45pm - 5:10pm | MS-16: Pre and post publication peer review of crystallographic data Location: Terrace 2A Session Chair: Mariusz Jaskolski Session Chair: Anthony Linden Invited: Stephen K. Burley (USA), Brian McMahon (UK) |
| 2:55pm - 5:55pm | SF-1: Software Fayre 1 Location: 221-2 Session Chair: Martin Lutz |
| 3:45pm - 5:15pm | MS-15: Integrative methodologies for novel thin film structures Location: 223-4 Session Chair: David Babonneau Session Chair: Baerbel Krause Invited: Jolien Dendooven (Belgium), Byeongdu Lee (USA) |
| 5:10pm - 6:10pm | Afternoon break 1: Poster session A1, exhibition, coffee/tea Location: Exhibition and poster area |
| 5:10pm - 6:10pm | Poster - 01 Bioinformatics: Structural bioinformatics Session Chair: Jiri Cerny Session Chair: Bohdan Schneider Session Chair: Janusz Marek Bujnicki
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| 5:10pm - 6:10pm | Poster - 02 Drug design: Drug design Session Chair: Begoña Heras Session Chair: Anton V. Zavialov
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| 5:10pm - 6:10pm | Poster - 03 Structure prediction: Crystal structure prediction Session Chair: Qiang Zhu
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| 5:10pm - 6:10pm | Poster - 04 Photochemistry: Solid state photo chemistry
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| 5:10pm - 6:10pm | Poster - 05 MOF: Metal-organic frameworks Session Chair: Sergei Alexandrovich Sapchenko Session Chair: Yue-Biao Zhang
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| 5:10pm - 6:10pm | Poster - 06 Perovskites: Perovskites Session Chair: Philip Lightfoot Session Chair: Chris Ling
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| 5:10pm - 6:10pm | Poster - 07 Powder: Powder diffraction - general, structure refinement
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| 5:10pm - 6:10pm | Poster - 08 General: General interest
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| 5:10pm - 6:10pm | Workshop - High Score: Easy automation and more accurate analysis with High Score Plus (V4) Location: virtual Website - virtual |
| 6:10pm - 7:00pm | KN-4: Crystal forms in pharmaceutical applications Location: Terrace 2B Session Chair: Marijana Đaković Susan Reutzel-Edens |
| 6:10pm - 7:00pm | KN-5: State of the art understanding of diffraction from aperiodic crystals Location: Terrace 2A Session Chair: Ma. Louise Antonette Navarro De Las Peñas Uwe Grimm |
| 6:10pm - 7:00pm | KN-6: The Coronavirus Structural Task Force Location: Club A Session Chair: Marcin Nowotny Andrea Thorn |
| 7:15pm - 10:15pm | IUCr: IUCr assembly Location: Club H Session Chair: Sven Lidin Session Chair: Alex Ashcroft Session Chair: Luc Van Meervelt IUCr assembly 1 Videos: Finance report -
Part 2 |
| Date: Monday, 16/Aug/2021 | |
| 9:00am - 9:50am | KN-7: Electron crystallography of molecular crystals Location: Terrace 2A Session Chair: Václav Petříček Lukáš Palatinus |
| 9:00am - 9:50am | KN-8: Order and disorder in metal-ion battery materials Location: Terrace 2B Session Chair: Radovan Cerny Artem Abakumov |
| 9:00am - 9:50am | KN-9: Crystalline sponge, metal-organic assembles Location: Club A Session Chair: Masaki Kawano Makoto Fujita |
| 9:50am - 10:20am | Morning break 2: Exhibition, posters, coffee/tea Location: Exhibition and poster area |
| 10:20am - 12:45pm | MS-17: Automation in bio-crystallography: tools, perspectives and applications Location: Club A Session Chair: Santosh Panjikar Session Chair: Melanie Vollmar Invited: Katherine McAuley (UK), Jose Marquez (France) |
| 10:20am - 12:45pm | MS-18a: Phase transitions in complex materials (structure and magnetism) I Location: Terrace 2B Session Chair: Yuichi Shimakawa Session Chair: Alexandra Gibbs Invited: Midori Amano Patino (Japan), Patrick Woodward (USA) |
| 10:20am - 12:45pm | MS-19: Crystal structures of pharmaceutical and organic compounds from electron diffraction Location: Terrace 2A Session Chair: Ute Kolb Session Chair: Petr Brazda Invited: Enrico Mugnaioli (Italy), Brent Nannega (USA) |
| 10:20am - 12:45pm | MS-20: Dynamic frameworks Location: Club C Session Chair: Christopher SUMBY Session Chair: Michael John Zaworotko Invited: Hoi Ri Moon (Republic of Korea), Yao Chen (China) |
| 10:20am - 12:45pm | MS-21: Structure, modeling and properties of quasicrystals Location: Club B Session Chair: Michael Engel Session Chair: Cesar Baban Pay Gómez Invited: Tsunemoto Yamada (Japan), Priya Subramanian (UK) |
| 10:20am - 12:45pm | MS-22: Methods and software developments for magnetic-structure analysis Location: 223-4 Session Chair: J. Manuel Perez-Mato Invited: Juan Rodriguez-Carvajal (Spain), Václav Petříček (Czech Republic) |
| 10:20am - 12:45pm | MS-23: Ptychography: present and near future Location: Club D Session Chair: Manuel Guizar Sicairos Session Chair: Julio Cesar da Silva Invited: Chris Jacobsen (USA), Julian Reinhardt (USA) |
| 10:20am - 12:45pm | MS-24: Data-driven discovery in crystallography Location: Club H Session Chair: Olivier C. Gagné Session Chair: Anton Oliynyk Invited: Wenhao Sun (USA), Aria Mansouri Tehrani (Switzerland) |
| 10:20am - 12:45pm | SF-2: Software Fayre 2 Location: 221-2 Session Chair: Martin Lutz |
| 12:45pm - 2:45pm | Lunch 2: Exhibition, posters, lunches Location: Exhibition and poster area |
| 12:45pm - 2:45pm | Meeting ECA1: ECA Council Meeting Location: Club H Session Chair: Udo Heinemann Session Chair: Arie van der Lee ECA council meeting 1 |
| 1:30pm - 2:00pm | CS-2: Commercial session: Xenocs Location: Terrace 2A Session Chair: Jerome Boutant Session Chair: Milan Dopita 30 min company presentation |
| 2:00pm - 2:30pm | CS-3: Why Spot-Cap® is the best option for protein purification (Chromotek) Location: Terrace 2A Session Chair: Milan Dopita 30 min company presentation |
| 2:45pm - 5:10pm | MS-25: Structural biology against coronavirus/covid-1 Location: Club A Session Chair: Sarah EJ Bowman Session Chair: Lu Zhang Session Chair: Gianluca Santoni Invited: Xuhui Huang (China) |
| 2:45pm - 5:10pm | MS-26: Solution scattering and combined techniques for biological systems, including component dynamics Location: Club B Session Chair: Frank Gabel Session Chair: Masaaki Sugiyama Invited: Mitsunori Ikeguchi (Japan), Anne Martel (France) |
| 2:45pm - 5:10pm | MS-27: New trends in pharmaceutical materials Location: Club D Session Chair: Nikoletta B. Bathori Session Chair: Laszlo Fabian Invited: Tonglei Li (USA), Doris Braun (Austria) |
| 2:45pm - 5:10pm | MS-28: Theory and practice of supramolecular synthons in crystal engineering Location: Club C Session Chair: Seiji Tsuzuki Session Chair: Alessia Bacchi |
| 2:45pm - 5:10pm | MS-29: Texture, strain and structure in metals and ceramics Location: 223-4 Session Chair: David Rafaja Ivnited: Efthymios Polatidis (Switzerland), Jana Šmilauerová (Czech Republic) |
| 2:45pm - 5:10pm | MS-30: Magnetic structures of novel and functional materials Location: Club H Session Chair: Virginie Simonet Session Chair: Václav Petříček Invited: Wei Tian (USA), Jonathan White (Switzerland) |
| 2:45pm - 5:10pm | MS-31: Recent advances in instrumentation Location: Terrace 2B Session Chair: Ehrenfried Zschech Session Chair: Michele Cianci Invited: Wenbing Yun (USA), Andrew Thomson (France) |
| 2:45pm - 5:10pm | MS-32: Recent advances in electron crystallography techniques Location: Terrace 2A Session Chair: Jim Ciston Session Chair: Mauro Gemmi Invited: Hongyj Xu (Sweden), Emanuela Liberti (UK) |
| 2:45pm - 5:10pm | SMS-2: Exemplary practice in chemical, biological and materials database archiving Location: 221-2 Session Chair: Suzanna Ward Session Chair: Genji Kurisu Invited: Ian Bruno (UK), Stephen Burley (USA) |
| 5:10pm - 6:10pm | Afternoon break 2: Poster session A2, exhibition, coffee/tea Location: Exhibition and poster area |
| 5:10pm - 6:10pm | Poster - 09 Automation in bio: Automation in biocrystallography Session Chair: Santosh Panjikar Session Chair: Melanie Vollmar
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| 5:10pm - 6:10pm | Poster - 10: Solution scattering Session Chair: Frank Gabel Session Chair: Masaaki Sugiyama
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| 5:10pm - 6:10pm | Poster - 11 Viruses: Structural biology of viruses
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| 5:10pm - 6:10pm | Poster - 12 Supramolecular: Theory and practice of supramolecular synthons in crystal engineering Session Chair: Alessia Bacchi Session Chair: Seiji Tsuzuki
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| 5:10pm - 6:10pm | Poster - 13 Data: Crystallographic data Session Chair: Olivier C. Gagné Session Chair: Anton Oliynyk
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| 5:10pm - 6:10pm | Poster - 14 Instrumentation: Advances in instrumentation Session Chair: Michele Cianci Session Chair: Ehrenfried Zschech
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| 5:10pm - 6:10pm | Poster - 15 Films: Crystallographic analysis of thin films and surfaces Session Chair: Milan Dopita
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| 5:10pm - 6:10pm | Poster - 16 Texture, defects: Texture, strain, stress, real structure Session Chair: David Rafaja
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| 6:10pm - 7:00pm | KN-10: Gjonnes medal lecture Location: Terrace 2A Session Chair: Louisa Meshi Ute Kolb, Sven Hovmöller |
| 6:10pm - 7:00pm | KN-11: Dithiadiazolyl radicals as building blocks for molecular magnetic materials Location: Terrace 2B Session Chair: Václav Petříček Delia Haynes |
| 6:10pm - 7:00pm | KN-12: Structural hybrid methods to probe membrane transport nanomachines in pathogenic bacteria Location: Club A Session Chair: Julie Bouckaert Natalie Strynadka |
| 7:15pm - 10:15pm | IUCr-2: IUCr assembly Location: Club H Session Chair: Sven Lidin Session Chair: Luc Van Meervelt Session Chair: Alex Ashcroft IUCr assembly 2 |
| Date: Tuesday, 17/Aug/2021 | |
| 9:00am - 9:50am | KN-13: Structural flexibility and disorder in functional materials Location: Terrace 2A Session Chair: Brendan Kennedy Andrew Goodwin |
| 9:00am - 9:50am | KN-14: Quantum crystallography and spintronic materials Location: Terrace 2B Session Chair: Krzysztof Wozniak Piero Macchi |
| 9:00am - 9:50am | KN-15: Time resolved macromolecular crystallography Location: Club A Session Chair: Ivana Kuta Smatanova Arwen R Pearson |
| 9:50am - 10:20am | Morning break 3: Exhibition, posters, coffee/tea Location: Exhibition and poster area |
| 10:20am - 12:45pm | MS-33: CryoEM for macromolecules - from single particles to microcrystals Location: Club A Session Chair: Jan Pieter Abrahams Session Chair: Jiri Novacek Invited: Nenad Ban (Switzerland), Dimple Karia (Netherlands) |
| 10:20am - 12:45pm | MS-34a: Structural biology of enzymes, mechanism and regulation Location: Club B Session Chair: Mirjam Czjzek Invited: Liang Wu (UK), Orsolya Barabas (Germany) |
| 10:20am - 12:45pm | MS-35: Polymorphism and structural transformation of organic crystals from synthesis to characterization Location: Club D Session Chair: Kenneth D. M. Harris Session Chair: Doris E. Braun Invited: David Bryce (Canada), Franziska Emmerling (Germany) |
| 10:20am - 12:45pm | MS-36: Generalizations of crystallographic groups and their applications Location: 221-2 Session Chair: Gregory L McColm Session Chair: Eden Delight Miro Invited: Pavel Kalouguine (France), Martin Cramer Pedersen (Denmark) |
| 10:20am - 12:45pm | MS-37: Total scattering Location: Terrace 2A Session Chair: Pierre Bordet Session Chair: Emil Bozin Invited: Stephan Rosenkranz (USA), Bo Brummerstedt Iversen (Denmark) |
| 10:20am - 12:45pm | MS-38: Structural, electronic and magnetic ordering: From fundamental physics to functionality Location: Club C Session Chair: Javier Sanchez-Benitez Session Chair: Ovidiu Garlea Invited: Christian Balz (USA), Mark Senn (UK) |
| 10:20am - 12:45pm | MS-39: Quantum crystallography in materials science Location: Terrace 2B Session Chair: Simon Grabowsky Session Chair: Jean-Michel Gillet Invited: Rebecca Scatena (UK), Cherif Matta (Canada) |
| 10:20am - 12:45pm | MS-40: New applications of coherent scattering Location: 223-4 Session Chair: Ian Robinson Session Chair: Christian Gutt Invited: Johanned Ihli (Switzerland), Foivos Perakis (Sweden) |
| 10:20am - 12:45pm | SMS-3: Online crystallography: Tools, apps and web services Location: Club H Session Chair: Eugene Krissinel Session Chair: Christian Bertram Hübschle Invited: Mois Ilia Aroyo (Spain), Victor Lamzin (Germany) |
| 12:45pm - 2:45pm | ECA-ECM: ECM programme committees Location: Club H Session Chair: Sylvain Ravy ECM programme committee meetings -Versaille,Padova |
| 12:45pm - 2:45pm | Lunch 3: Exhibition, posters, lunches Location: Exhibition and poster area |
| 1:00pm - 2:00pm | Meeting 3 - Journals: Commission on Journals open meeting Location: Club A Session Chair: Andrew Allen Session Chair: Peter Raymond Strickland |
| 1:30pm - 2:00pm | CS-4: Commercial session - MiTeGen: Innovations in Crystallography and CryoEM Location: Terrace 2A Session Chair: Milan Dopita 30 min company presentation |
| 2:50pm - 3:40pm | PL-1: How data have revealed the structural universe Location: Panorama Session Chair: John Richard Helliwell Helen Berman |
| 3:45pm - 4:40pm | Bragg: W.H. and W.L. Bragg Prize Location: Panorama Session Chair: Elena Boldyreva |
| 4:40pm - 5:40pm | Afternoon break 3: Poster session B1, exhibition, coffee/tea Location: Exhibition and poster area |
| 4:40pm - 5:40pm | Poster - 17 Biocrystallography: Macromolecular and biological crystallography
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| 4:40pm - 5:40pm | Poster - 18 CryoEM: Cryo-EM Session Chair: Jose-Maria Carazo Session Chair: Jiri Novacek
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| 4:40pm - 5:40pm | Poster - 19 Pharmaceutical: Pharmaceutical materials Session Chair: Nikoletta B. Bathori Session Chair: Laszlo Fabian Comment |
| 4:40pm - 5:40pm | Poster - 20 Polymorphism: Polymorphism Session Chair: Doris E. Braun Session Chair: Kenneth D. M. Harris
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| 4:40pm - 5:40pm | Poster - 21 Quantum: Quantum crystallography Session Chair: Chérif F. Matta Session Chair: Anna Maria Makal Session Chair: PIERO MACCHI Session Chair: Katarzyna N. Jarzembska
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| 4:40pm - 5:40pm | Poster - 22 Ptychography: Ptychography, imaging, coherent scattering Session Chair: Sine Larsen Session Chair: Ian Robinson
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| 6:30pm - 7:15pm | Refreshment: Refreshment Location: Exhibition and poster area |
| 7:15pm - 8:45pm | Cultural programme: Concert - Dvorak ensemble Ensemble Website |
| Date: Wednesday, 18/Aug/2021 | |
| 9:00am - 9:50am | KN-16: MicroED: conception, practice and future opportunities Location: Terrace 2A Session Chair: Louisa Meshi Tamir Gonen |
| 9:00am - 9:50am | KN-17: In-situ and In-operando diffraction Studies of Li Ion Battery Electrodes Location: Terrace 2B Session Chair: Radovan Cerny Gwenaelle Rousse |
| 9:00am - 9:50am | KN-18: Electron density, and its interplay with the energy and properties of molecules and solids Location: Club A Session Chair: Catharine Esterhuysen Julia Contreras-Garcia |
| 9:50am - 10:20am | Morning break 4: Exhibition, posters, coffee/tea Location: Exhibition and poster area |
| 10:20am - 12:45pm | MS-41: Macromolecular machines and hybrid methods to crystallography Location: Club B Session Chair: Michael Landsberg Session Chair: Dmitry Svergun Invited: Kristina Djinovic-Carugo (Austria), Tanmay Bharat (India) |
| 10:20am - 12:45pm | MS-42: Novel techniques and insights into in vitro and in situ crystallisation for X-ray and electron diffraction. Location: Club A Session Chair: Lars Redecke Session Chair: Fasseli Coulibaly Invited: Haruki Hasegawa (USA), Alexandra Ros (USA) |
| 10:20am - 12:45pm | MS-43: Solid state reactions and dynamics Location: Terrace 2B Session Chair: Franziska Emmerling Session Chair: Javier Marti-Rujas Invited: Hiroyoshi Ohtsu (Japan), Paolo Pio Mazzeo (Italy) |
| 10:20am - 12:45pm | MS-44: Beyond pure point diffraction: Theory and application of diffuse scattering Location: Club H Session Chair: Nicolae Strungaru Session Chair: Uwe Grimm Invited: Chrizaldi Neil Manibo (Germany), Ella Mara Schmidt (Germany) |
| 10:20am - 12:45pm | MS-45: Frustrated magnetic order and emerging science Location: Club C Session Chair: Romain Sibille Session Chair: Geetha Balakrishnan Invited: Beauvois Ketty (France), Nicolas Gauthier (USA) |
| 10:20am - 12:45pm | MS-46: In-situ and in operando studies of battery materials Location: Club D Session Chair: Vanessa Kate Peterson Session Chair: Claire Villevieille Invited: Karena Chapman (USA), Sandrine Lyonnard (France) |
| 10:20am - 12:45pm | MS-47a: Nanocrystalline materials I Location: 223-4 Session Chair: Cinzia Giannini Session Chair: Jinong Zhu Invited: Junliang Sun (China), Ulf Olsson (Sweden) |
| 10:20am - 12:45pm | MS-48: Combination of X-rays and electrons for structure characterization Location: Terrace 2A Session Chair: Joke Hadermann Session Chair: Junliang Sun Invited: Stef Smeets (Netherlands), Tatiana Gorelik (Germany) |
| 10:20am - 12:45pm | SF-3: Software Fayre 3 Location: 221-2 Session Chair: Martin Lutz Session Chair: Claudia Millán |
| 12:45pm - 2:45pm | Lunch 4: Exhibition, posters, lunches Location: Exhibition and poster area |
| 12:45pm - 2:45pm | Meeting ECA2: ECA Council Meeting Location: Club H Session Chair: Udo Heinemann Session Chair: Arie van der Lee ECA council meeting 2 |
| 1:00pm - 2:00pm | Workshop - Journals: Journal Author Workshop. From data to publication Location: Club A Session Chair: Andrew Allen Session Chair: Michele Zema Panelists: Elspeth Garman (Acta D); Chiara Massera (Acta E); Andrew Allen (Editor-in-Chief) Managing editors and IUCr staff: Louise Jones (Acta D); Michele Zema (Executive Outreach Officer) |
| 2:45pm - 5:10pm | MS-49: Protein design and engineering Location: Club A Session Chair: Charlotte Uetrecht Session Chair: Sheena McGowan |
| 2:45pm - 5:10pm | MS-51: Molecular magnets and metal-organic frameworks including quantum crystallography approaches Location: Club B Session Chair: Jozef Kozisek Session Chair: Verónica Paredes-García Invited: Ivan Němec (Czech Republic), Lorraine Andrade Malaspina (France) |
| 2:45pm - 5:10pm | MS-52: Combining X-ray diffraction and spectroscopy to characterise materials Location: Terrace 2A Session Chair: Carlo Meneghini Session Chair: Siegbert Schmid Invited: Ilaria Carlomagno (Italy), Marco Giorgetti (Italy) |
| 2:45pm - 5:10pm | MS-53: Function and application of porous crystals Location: Club C Session Chair: Karena Chapman Session Chair: Fernando Uribe-Romo |
| 2:45pm - 5:10pm | MS-54: Materials for energy conversion and storage Location: Terrace 2B Session Chair: Jean-Marc Joubert Session Chair: Stefan Adams Invited: Yaroslav Filinchuk (Belgium), Kent Griffith (USA) |
| 2:45pm - 5:10pm | MS-55(47b): Nanocrystalline materials II Location: 223-4 Session Chair: Cinzia Giannini Session Chair: Jinong Zhu |
| 2:45pm - 5:10pm | MS-56: Analysis of the fine structure in electron diffraction data Location: Club H Session Chair: Tatiana Gorelik Session Chair: Xiaodong Zou Invited: Paul Voyles (USA), Cheuk-Wai Tai (Sweden) |
| 2:45pm - 5:10pm | SMS-4: Using crystallography for education during the pandemic Location: Club D Session Chair: Oluwatoyin Asojo Invited: Karsten Theis (USA) |
| 2:55pm - 5:55pm | SF-4: Software Fayre 4 Location: 221-2 Session Chair: Martin Lutz |
| 5:10pm - 6:10pm | Afternoon break 4: Poster session B2, exhibition, coffee/tea Location: Exhibition and poster area |
| 5:10pm - 6:10pm | Poster - 23 Protein design: Protein design and engineering Session Chair: Sheena McGowan Session Chair: Charlotte Uetrecht
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| 5:10pm - 6:10pm | Poster - 24 Crystallization: Crystallization Session Chair: Duane Choquesillo-Lazarte
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| 5:10pm - 6:10pm | Poster - 25 Electron: Electron crystallography Session Chair: Petr Brazda
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| 5:10pm - 6:10pm | Poster - 26 Spectroscopy: Combining X-Ray Diffraction and Spectroscopy to Characterise Materials Session Chair: Carlo Meneghini Session Chair: Siegbert Schmid |
| 5:10pm - 6:10pm | Poster - 27 Magnetism: Magnetic structures, magnetic materials
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| 5:10pm - 6:10pm | Poster - 28 Porous: Porous materials Session Chair: Karena Chapman Session Chair: Fernando Uribe-Romo
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| 5:10pm - 6:10pm | Poster - 29 Solid state: Solid state reactions and dynamics Session Chair: Javier Marti-Rujas Session Chair: Franziska Emmerling
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| 5:10pm - 6:10pm | Poster - 30 Nano: Nanomaterials Session Chair: Cinzia Giannini Session Chair: Jinong Zhu
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| 5:10pm - 6:10pm | Poster - 31 Total: Total scattering Session Chair: Emil Bozin Session Chair: Pierre Bordet
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| 5:10pm - 6:10pm | Poster - 32 Theory: Theoretical crystallography
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| 6:10pm - 7:00pm | KN-19: X-ray absorption spectroscopy and materials science: recent advances Location: Terrace 2A Session Chair: Giuliana Aquilanti Federico Boscherini |
| 6:10pm - 7:00pm | KN-20: The benefits of Scanning Precession Electron Diffraction to access to the crystallographic phases and orientations of nanomaterials Location: Terrace 2B Session Chair: Louisa Meshi Edgar Rauch |
| 6:10pm - 7:00pm | KN-21: How limitless antibodies are generated by V(D)J recombination Location: Club A Session Chair: Marcin Nowotny Wei Yang |
| 8:00pm - 10:00pm | Boat trip: Boat trip with raut Extra fee |
| Date: Thursday, 19/Aug/2021 | |
| 9:00am - 9:50am | KN-22: Record High superconductivity in sodalite-like rare-earth hydrides stabilized at high pressures Location: Terrace 2A Session Chair: Arthur Haozhe Liu Yanming Ma |
| 9:00am - 9:50am | KN-23: Novel insights on biomineralization using x-rays and optical coherent diffraction based imaging Location: Terrace 2B Session Chair: Juan Manuel Garcia-Ruiz Virginie Chamard |
| 9:00am - 9:50am | KN-24: Regulation of gene expression by transcription factors and RNA-binding proteins Location: Club A Session Chair: Pavlína Řezáčová Udo Heinemann |
| 9:50am - 10:20am | Morning break 5: Posters, coffee/tea Location: Exhibition and poster area |
| 10:20am - 12:45pm | MS-57: Neutron scattering - sources, applications Location: Terrace 2B Session Chair: Matthew Paul Blakeley Session Chair: Flora Meilleur Session Chair: Esko Oksanen Invited: Gloria Borgstahl (USA), Svetlana Antonyuk (UK) |
| 10:20am - 12:45pm | MS-58: Ultra-high resolution macromolecular crystallography and quantum biocrystallography Location: Club A Session Chair: Christian Jelsch Session Chair: Alexander Wlodawer Invited: Paulina Dominiak (Poland), Maciej Kubicki (Poland) |
| 10:20am - 12:45pm | MS-59: Crystal chemistry with emerging technology I Location: Terrace 2A Session Chair: Consiglia Tedesco Session Chair: Toru Asahi Invited: Sota Sato (Japan), Marijana Dakovic (Croatia) |
| 10:20am - 12:45pm | MS-60: Composite and incommensurate modulated crystals: structural and physical properties Location: Club B Session Chair: Sylvain Ravy Session Chair: Sander van Smaalen Invited: Stephan J. Skinner (UK), Vincent Jacques (France) |
| 10:20am - 12:45pm | MS-61: Magnetic structures at extreme conditions and in extreme samples Location: Club D Session Chair: Angel M. Arevalo-Lopez Session Chair: Andrzej Katrusiak Invited: Elena Solana-Madruga (UK), Dawid Pinkowicz (Poland) |
| 10:20am - 12:45pm | MS-62: The mineral/life interface - prebiotic chemistry, biomineralization, advanced biomimetic materials Location: Club C Session Chair: Juan Manuel Garcia-Ruiz Session Chair: Giuseppe Falini Invited: Boaz Pokroy (Israel), Abel Moreno (Mexiko) |
| 10:20am - 12:45pm | MS-63: Catalysis: functionalized materials studied by XRD and XAFS Location: 223-4 Session Chair: Valérie Briois Session Chair: Andreas Roodt Invited: Elisa Borfecchia (Italy), Ola F Wendt (Sweden) |
| 10:20am - 12:45pm | MS-64: In-situ and time resolved electron crystallography Location: Club H Session Chair: Andrew Alexander Stewart Session Chair: Eva Olsson Invited: David Flannigan (USA), Maria Batuk (Belgium) |
| 12:45pm - 2:45pm | Lunch 5: Posters, lunches Location: Exhibition and poster area |
| 1:00pm - 2:30pm | ECA - GIG-1: ECA - GIG-1 Young Crystallographers Location: Club A |
| 1:00pm - 2:30pm | ECA - SIG-12: ECA - SIG-12 Crystallography of Functional Materials Location: 223-4 |
| 1:00pm - 2:30pm | ECA - SIG-1: ECA - SIG-1 Macromolecular Crystallography Location: Club D |
| 1:00pm - 2:30pm | ECA - SIG-3: ECA - SIG-3 Aperiodic Crystals Location: virtual |
| 1:00pm - 2:30pm | ECA - SIG-5: ECA - SIG-5 Mineral and Inorganic Crystallography Location: Club B SIG - 5 |
| 1:00pm - 2:30pm | ECA - SIG-6: ECA - SIG-6 Instrumentation and Experiment Location: Club C |
| 1:00pm - 2:30pm | Meeting - Quantum: Commission on Quantum Crystallography Open Meeting Location: Club H Session Chair: Paulina Maria Dominiak |
| 1:45pm - 2:45pm | ECA - SIG-4: ECA - SIG-4 Electron Crystallography Location: 221-2 |
| 2:00pm - 2:45pm | ECA - GIG-3: ECA - GIG-3 Education in Crystallography Location: virtual |
| 2:45pm - 5:10pm | MS-65: Graphs, tilings and crystal structures Location: Club D Session Chair: Mark Loyola Session Chair: Bernd Souvignier Invited: Vladislav A. Blatov (Russia), Jean-Guillaume Eon (Brazil) |
| 2:45pm - 5:10pm | MS-66: Integrative structural biology: The next 50 years of the Protein Data Bank Location: Club H Session Chair: Stephen K. Burley Session Chair: Dina Schneidman Invited: Andrej Sali (USA), Fei Xu (China) |
| 2:45pm - 5:10pm | MS-67: Crystallization mechanisms of small molecule systems Location: Terrace 2B Session Chair: Duane Choquesillo-Lazarte Invited: Ian Rosbottom (UK), Aurora Cruz-Cabeza (UK) |
| 2:45pm - 5:10pm | MS-68: Symmetry aspects of magnetic order and magnetic properties Location: Club B Session Chair: Mois Ilia Aroyo Session Chair: Margarida Henriques Invited: Laura Chaix (France), Fabio Orlandi (UK) |
| 2:45pm - 5:10pm | MS-69a: Complex crystal structures - chemical crystallography Location: Club A Session Chair: Marie Colmont Session Chair: Sergey V. Krivovichev |
| 2:45pm - 5:10pm | MS-70: Matter at extreme conditions at SR and XFEL: complementarity of spectroscopy and diffraction Location: Club C Session Chair: Angelika Dorothea Rosa Session Chair: Ulf Zastrau Invited: Virginia Monteseguro (Spain, ESRF), Emma McBride (USA, SLAC) |
| 2:45pm - 5:10pm | MS-71a: Disordered materials: spectroscopic and scattering techniques I Location: Terrace 2A Session Chair: Simon Billinge Session Chair: Angela Trapananti Invited: Takeshi Egami (USA), Shinya Hosokawa (Japan) |
| 2:45pm - 5:10pm | MS-72: New methods and strategies in NMR crystallography - in Honour of Francis Taulelle Location: 223-4 Session Chair: Martin Dracinsky Session Chair: David Bryce Invited: Sharon Ashbrook (UK), Lyndon Emsley (Switzerland) |
| 2:55pm - 5:55pm | SF-5: Software Fayre 5 Location: 221-2 Session Chair: Martin Lutz Session Chair: Claudia Millán |
| 5:10pm - 6:10pm | Afternoon break 5: Poster session C1, coffee/tea Location: Exhibition and poster area |
| 5:10pm - 6:10pm | Poster - 33 Chemical: Chemical crystallography
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| 5:10pm - 6:10pm | Poster - 34 Catalysis: Catalysis Session Chair: Valérie Briois Session Chair: Andreas Roodt
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| 5:10pm - 6:10pm | Poster - 35 Modulated: Composite and Incommensurate Modulated Crystals Session Chair: Sander van Smaalen Session Chair: Sylvain Ravy
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| 5:10pm - 6:10pm | Poster - 36 Disordered: Disordered materials Session Chair: Simon Billinge Session Chair: Angela Trapananti
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| 5:10pm - 6:10pm | Poster - 37 Biomineralization: Biomineralization, advanced biomimetic materials Session Chair: Giuseppe Falini Session Chair: Juan Manuel Garcia-Ruiz
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| 5:10pm - 6:10pm | Poster - 38 Energy: Materials for energy conversion and storage Session Chair: Stefan Adams Session Chair: Jean-Marc Joubert
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| 5:10pm - 6:10pm | Poster - 39 Neutrons: Neutron scattering Session Chair: Esko Oksanen Session Chair: Matthew Paul Blakeley Session Chair: Jiri Kulda
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| 5:10pm - 6:10pm | Poster - 40 NMR: NMR crystallography Session Chair: David Bryce Session Chair: Martin Dracinsky
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| 6:10pm - 7:00pm | KN-25: A Crystallographic Snapshot of SARS-CoV-2 Main Protease Maturation Process and the Discovery of Inhibitors Location: Club A Session Chair: Julie Bouckaert Glaucius Oliva |
| 6:10pm - 7:00pm | KN-26: Complexity in crystals and minerals Location: Terrace 2A Session Chair: Milan Rieder Sergey Krivovichev |
| 6:10pm - 7:00pm | KN-27: The crystal and the rose: On the impact of crystals and crystallography in art and mind Location: Terrace 2B Session Chair: Abel MORENO Juan Manuel García-Ruiz |
| 7:10pm - 7:50pm | PL-2: In situ and ex situ studies of battery materials with magnetic resonance and diffraction methods Location: Terrace 2A Session Chair: Juergen Senker Clare Grey |
| 7:50pm - 10:15pm | IUCr-3: IUCr assembly Location: Club H Session Chair: Sven Lidin Session Chair: Luc Van Meervelt Session Chair: Alex Ashcroft IUCr assembly 3 |
| Date: Friday, 20/Aug/2021 | |
| 9:00am - 9:50am | KN-28: 4th generation SR and XFEL facilities: new era in crystallography and material science Location: Terrace 2A Session Chair: Elena Boldyreva Aleksandr Blagov |
| 9:00am - 9:50am | KN-29: Crystal engineering of adaptive smart materials: from mechanical bending to self-healing Location: Terrace 2B Session Chair: Masaki Kawano Malla Reddy |
| 9:00am - 9:50am | KN-30: Structure guided inhibitor discovery targeting a membrane receptor involved in atherosclerosis Location: Club A Session Chair: Julie Bouckaert Arockiasamy Arulandu |
| 9:50am - 10:20am | Morning break 6: Posters, coffee/tea Location: Exhibition and poster area |
| 10:20am - 12:45pm | MS-73: Machine learning in biological and structural sciences Location: Terrace 2B Session Chair: Rita Giordano Session Chair: Harold Roger Powell Invited: Melanie Vollmar (UK), Sergei Grudinin (France) |
| 10:20am - 12:45pm | MS-74: Structural biology of receptors, signaling and membrane proteins Location: Club A Session Chair: SUSAN KAY BUCHANAN Session Chair: Michael Parker Invited: Robert Keenan (USA), Isabel Moraes (UK) |
| 10:20am - 12:45pm | MS-75: Small- and Wide-Angle Scattering for industrial materials far from equilibrium Location: Club D Session Chair: Jan Ilavsky Session Chair: Semra IDE Invited: Masato Ohnuma (Japan), Elliot Paul Gilbert (Australia) |
| 10:20am - 12:45pm | MS-76(59b): Crystal chemistry with emerging technology II Location: Club C Session Chair: Consiglia Tedesco Session Chair: Toru Asahi |
| 10:20am - 12:45pm | MS-77(71b): Disordered materials: spectroscopic and scattering techniques II Location: 223-4 Session Chair: Simon Billinge Session Chair: Angela Trapananti Invited: Lars G. M. Pettersson (Sweden), Maxwell Terban (Germany) |
| 10:20am - 12:45pm | MS-78: Science meets art: X-ray spectrometry and X-ray diffraction in art and archaeology Location: Club H Session Chair: Gilberto Artioli Session Chair: Sebastian Bette Invited: Katrien Keune (Netherlands), Christoph Berthold (Germany) |
| 10:20am - 12:45pm | MS-79(69b): Complex structures of minerals and inorganic materials Location: Club B Session Chair: Marie Colmont Session Chair: Sergey V. Krivovichev |
| 10:20am - 12:45pm | MS-80: 4th generation SR and XFEL Facilities Location: Terrace 2A Session Chair: Makina Yabashi Session Chair: Sofia Diaz-Moreno Invited: Jean Susini (France) |
| 12:45pm - 2:45pm | Lunch 6: Posters, lunches Location: Exhibition and poster area |
| 1:00pm - 2:30pm | ECA - SIG-11: ECA - SIG-11 Crystallography under Extreme Conditions Location: Club A |
| 1:00pm - 2:30pm | ECA - SIG-13: ECA - SIG-13 Molecular Structure and Chemical Properties Location: virtual |
| 1:00pm - 2:30pm | ECA - SIG-14: ECA - SIG-14 Dynamics, Disorder, Diffuse Scattering Location: Club D |
| 1:00pm - 2:30pm | ECA - SIG-2: ECA - SIG-2 Quantum Crystallography Location: Club H |
| 1:00pm - 2:30pm | ECA - SIG-9: ECA - SIG-9 Crystallographic Computing Location: virtual |
| 1:00pm - 2:30pm | ECA-1: ECA EC meeting 2 Location: Club C Session Chair: Udo Heinemann Session Chair: Arie van der Lee ECA EC meeting |
| 1:45pm - 2:45pm | ECA - SIG-7: ECA - SIG-7 Molecular Interaction and Recognition Location: virtual |
| 2:45pm - 3:50pm | SMS-6: Spectroscopy applied to electrochemistry: operando studies Location: Club C Session Chair: Jasper Rikkert Plaisier Session Chair: Dibyendu Bhattacharyya Invited: Moniek Tromp (The Netherlands), Mahalingam Balasubramanian (USA) |
| 2:45pm - 5:10pm | MS-81: Nucleic acids and binding proteins structure and function Location: Club A Session Chair: Stephen Neidle Session Chair: Charles Bond Invited: Millie Georgiadis (USA), Liliya Yatsunyk (USA) |
| 2:45pm - 5:10pm | MS-82: Handling of big data in crystallography Location: 223-4 Session Chair: Wladek Minor Session Chair: Brinda Vallat |
| 2:45pm - 5:10pm | MS-83: High pressure crystallography Location: Terrace 2A Session Chair: Lars Ehm Session Chair: Jon Henry Eggert Session Chair: Vitali Prakapenka Session Chair: Przemyslaw Dera Merged sessions |
| 2:45pm - 5:10pm | MS-85: Science meets art: Crystallography and cultural heritage Location: Club H Session Chair: Alicja Rafalska-Lasocha Session Chair: Petr Bezdicka Invited: Koen Janssens (Belgium), Sebastian Bette (Germany) |
| 2:45pm - 5:10pm | MS-86: Modular structure of inorganic and mineral compounds Location: Club D Session Chair: Isabella Pignatelli Session Chair: Berthold Stöger Invited: Olivier Perez (France), Marie Colmont (France) |
| 2:45pm - 5:10pm | MS-87: Topological materials Location: Terrace 2B Session Chair: Yugui Yao Session Chair: Wenhui Duan Session Chair: Avadh B. Saxena Invited: Tomasz Dietl (Poland), Xiang Li (China) |
| 2:45pm - 5:10pm | MS-88: Quantum crystallography research Location: Club B Session Chair: Yu-Sheng Chen Session Chair: Katarzyna N. Jarzembska Invited: Sophie E. Canton (Hungary), Simon Grabowsky (Switzerland)
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| 2:55pm - 5:55pm | SF-6: Software Fayre 6 Location: 221-2 Session Chair: Martin Lutz Session Chair: Claudia Millán |
| 3:55pm - 5:25pm | SMS-5: Advances in data and model validation in biomolecular Small-Angle Scattering: Impacts on data and meta-data recording and data archiving Location: Club C Session Chair: Javier Perez Session Chair: Thomas Weiss Invited: Dina Schneidman (Israel), Thomas Grant (USA) |
| 5:10pm - 6:10pm | Afternoon break 6: Poster session C2, coffee/tea Location: Exhibition and poster area |
| 5:10pm - 6:10pm | Poster - 41 Receptors: Structural biology of receptors, membrane proteins Session Chair: SUSAN KAY BUCHANAN Session Chair: Michael Parker
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| 5:10pm - 6:10pm | Poster - 42 Enzymes: Structural biology of enzymes Session Chair: Mirjam Czjzek
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| 5:10pm - 6:10pm | Poster - 43 Nucleic acid: Nucleic acids and binding proteins structure and function Session Chair: Charles Bond Session Chair: Stephen Neidle
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| 5:10pm - 6:10pm | Poster - 44 Art: Crystallography in art and archaeology Session Chair: Petr Bezdicka Session Chair: David Hradil
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| 5:10pm - 6:10pm | Poster - 45 Minerals: Complex structures of minerals and inorganic materials Session Chair: Marie Colmont Session Chair: Sergey V. Krivovichev Session Chair: Milan Rieder
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| 5:10pm - 6:10pm | Poster - 46 SAXS: SAXS, SANS Session Chair: Semra IDE Session Chair: Jan Ilavsky
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| 5:10pm - 6:10pm | Poster - 47 Synchrotron and XFEL: Synchrotron and XFEL facilities Session Chair: Sofia Diaz-Moreno Session Chair: Makina Yabashi
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| 6:10pm - 7:00pm | KN-31: The contribution of crystallography to new vaccine formulations Location: Terrace 2A Session Chair: Graciela Carlota Díaz de Delgado Marcia Fantini |
| 6:10pm - 7:00pm | KN-32: Crystallography and cultural heritage - On beauty, science and passion Location: Terrace 2B Session Chair: Jose Miguel Delgado Gilberto Artioli |
| 6:10pm - 7:00pm | KN-33: Overview of Global Neutron Sources, Instruments and Initiatives Location: Club A Session Chair: Jiri Kulda Ken Andersen |
| 8:00pm - 11:55pm | Dinner: Conference dinner Location: National House extra fee |
| Date: Saturday, 21/Aug/2021 | |
| 9:00am - 9:50am | KN-34: Fabrication and Characterization of Inhomogeneity-free Polymer Gels Location: Club A Session Chair: Marijana Đaković Mitsushiro Shibayama |
| 9:00am - 9:50am | KN-35: The Science of Symmetry Breaking Location: Terrace 2A Session Chair: Oksana Zaharko Harold Stokes |
| 9:00am - 9:50am | KN-36: Metadata and checkCIF for raw diffraction data in realising ultimate crystallographic objectivity Location: Terrace 2B Session Chair: John Richard Helliwell Loes Kroon-Batenburg |
| 9:50am - 10:20am | Morning break 7: Coffee/tea Location: Exhibition and poster area |
| 10:20am - 12:45pm | MS-89: Fragment Screening, LCP, and Automation Location: Club B Session Chair: Alice Douangamath Session Chair: Lisa J. Keefe Invited: Martin Noble (UK), Kenton Longenecker (USA) |
| 10:20am - 12:45pm | MS-90: Structure solution and poorly crystalline materials Location: Terrace 2A Session Chair: Angela Altomare Invited: Martin Schmidt (Germany), Katharine Page (USA) |
| 10:20am - 12:45pm | MS-91: Time-resolved phase evolution, interaction & crystallization in soft matter: Integrative approaches Location: Club C Session Chair: Mitsuhiro Shibayama Session Chair: Jrjeng Ruan Invited: Julia Kornfield (USA), Christine M. Papadakis (Germany) |
| 10:20am - 12:45pm | MS-92 (34b): Structural biology of enzymes, mechanism and regulation II Location: Club A Session Chair: Mirjam Czjzek |
| 10:20am - 12:45pm | MS-93: Non-covalent interactions in crystal engineering I Location: Terrace 2B Session Chair: Giuseppe Resnati Session Chair: Petra Bombicz Invited: Deepak Chopra (India), Karah Knope (USA) |
| 10:20am - 12:45pm | MS-94: Organic minerals, metal-organic frameworks, and metal-oxygen clusters: the emergent interface of geochemistry and crystal engineering Location: Club D Session Chair: Igor Huskić Session Chair: Tomoji Ozeki Invited: Helen Maynard-Casely (Australia), Ulrich Kortz (Germany) |
| 10:20am - 12:45pm | MS-95: Advanced methods for analysis of XAFS and crystallographic data Location: 223-4 Session Chair: Marco Giorgetti Session Chair: Paula Macarena Abdala Invited: Paola D'angelo (Italy), Rocco Caliandro (Italy) |
| 10:20am - 12:45pm | MS-96: Crystallography schools to promote interdisciplinarity in science Location: Club H Session Chair: Alice Brink Session Chair: Serena Chiara Tarantino Invited: Diego German Lamas (Argentina), Marielle Yasmine Agbahoungbata (Benin) |
| 10:20am - 12:45pm | SMS-7: Hydrogen rich compounds: design, properties & phase transitions at high pressures Location: 221-2 Session Chair: Artem R Oganov Session Chair: Alexander Goncharov Invited: Chris J. Pickard (UK), Dmitry Semenok (Russia) |
| 12:45pm - 2:45pm | Lunch 7: Lunches Location: Exhibition and poster area |
| 2:45pm - 5:10pm | MS-100: Stimuli-responsive crystalline compounds Location: Club B Session Chair: Chiara Massera Session Chair: Ivan Halasz Invited: Tomce Runcevski (USA), Helena Shepherd (UK) |
| 2:45pm - 5:10pm | MS-101 (18b): Phase transitions in complex materials (structure and magnetism) II Location: Club A Session Chair: Yuichi Shimakawa Session Chair: Alexandra Gibbs |
| 2:45pm - 5:10pm | MS-102: Crystallography using large volume presses and diamond anvil cells Location: Terrace 2B Session Chair: Shanti Deemyad Session Chair: Ronald MILETICH Invited: Natalia Dubrovinskaia (Germany), Siddharth Saxena (UK) |
| 2:45pm - 5:10pm | MS-103: XAS and crystallography allied for geomaterials and environmental problems Location: 223-4 Session Chair: J. Fred Mosselmans Session Chair: Annalisa Martucci Invited: Giuseppe Cruciani (Italy), Georgia Cametti (Switzerland) |
| 2:45pm - 5:10pm | MS-104: Diffraction imaging, grain mapping in materials and art Location: Terrace 2A Session Chair: Jonathan Paul Wright Session Chair: Sine Larsen Invited: Ashley Bucsek (USA), Frederik Vanmeert (Belgium) |
| 2:45pm - 5:10pm | MS-97: New methods to fight the pandemic Location: Panorama Session Chair: Jane Shelby Richardson Session Chair: Nicholas Mark Pearce Invited: Jasmine Young (USA), Tristan Croll (UK) |
| 2:45pm - 5:10pm | MS-98: 2D type crystals and their heterostructures Location: Club C Session Chair: Matteo Bosi Session Chair: Adela Rodríguez-Romero Invited: Eli Sutter (USA), Xinliang Feng (Germany) |
| 2:45pm - 5:10pm | MS-99: Non-covalent interactions in crystal engineering II Location: Club D Session Chair: Giuseppe Resnati Session Chair: Petra Bombicz Invited: Andrea Pizzi (Italy), Christian Jelsch (France) |
| 5:10pm - 6:10pm | Afternoon break 7: Coffee/tea Location: Exhibition and poster area |
| 5:10pm - 6:10pm | Poster - 48 Fragment screening: Fragment screening Session Chair: Alice Douangamath Session Chair: Lisa J. Keefe
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| 5:10pm - 6:10pm | Poster - 49 Non-covalent: Non-covalent interactions in crystal engineering Session Chair: Petra Bombicz Session Chair: Giuseppe Resnati
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| 5:10pm - 6:10pm | Poster - 50 High Pressure: High Pressure Crystallography Session Chair: Przemyslaw Dera Session Chair: Jon Henry Eggert Session Chair: Lars Ehm Session Chair: Vitali Prakapenka
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| 5:10pm - 6:10pm | Poster - 51 Stimuli: Stimuli-responsive crystalline compounds Session Chair: Chiara Massera Session Chair: Ivan Halasz
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| 5:10pm - 6:10pm | Poster - 52 Time-resolved: Time resolved phase evolution, interaction and crystallization in soft matter Session Chair: Jrjeng Ruan Session Chair: Mitsuhiro Shibayama
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| 5:10pm - 6:10pm | Poster - 53 Phase transitions: Structure and phase transitions in advanced materials Session Chair: Alexandra Gibbs Session Chair: Yuichi Shimakawa
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| 5:10pm - 6:10pm | Poster - 54 Methods: Methods Date and time of the session to be determined. |
| 5:10pm - 6:10pm | Poster - 55 XAFS: XAFS Session Chair: Paula Macarena Abdala Session Chair: Marco Giorgetti
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| 6:10pm - 7:00pm | PL-3: The structural biology of pathogenic amyloid fibrils Location: Panorama David Eisenberg |
| 7:00pm - 7:45pm | Closing ceremony: Poster prizes, closing Location: Panorama |
| Date: Sunday, 22/Aug/2021 | |
| 8:10am - 5:00pm | Train trip Pilsen: Plzeň Session Chair: David Havlíček Prague (8:13 CHANGE - Pilsen, excursion in brewery, lunch, Pilsen - Prague (departure 15:22) |
| Date: Wednesday, 25/Aug/2021 | |
| 2:00pm - 6:00pm | Workshop - Resolution matters: Resolution Matters:- Discover the pathway from a high resolution 2D scan to the best phase analysis (Panalytical) Location: virtual Join us on 25th August 2pm with Alejandro Rodríguez Navarro Register Here: www.malvernpanalytical.com/IUCr2021
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| Date: Wednesday, 01/Sept/2021 | |
| 2:00pm - 8:00pm | School - Computing: Crystallographic Computing School Location: virtual Session Chair: Martin Lutz Session Chair: Claudia Millán The Computing School will cover aspects that are relevant to all fields of crystallographic computing. As the main topic we will focus on the determination and the use of eigenvectors and eigenvalues and their applications in the different fields of crystallography. Applications range from the well known principal component analysis and other statistical and machine learning techniques to modelling using Markov processes, or optimization of functions. Fields such as image processing, information theory, and crystallography make use of these in many of its most fundamental methods. It impacts directly macromolecular crystallography in both phasing and refinement aspects. In small molecule crystallography and materials science research, it allows the understanding of very fundamental physical properties of matter. In this school, our aim is to learn and teach about this general topic from the computing aspect of the fundamentals, but also the computing tools and the data. |
| 2:00pm - 8:00pm | School - ePDF: School on electron PDF (pair-distribution function) Location: virtual Session Chair: Tatiana Gorelik virtual meeting |
| Date: Thursday, 02/Sept/2021 | |
| 2:00pm - 8:00pm | School - Computing 2: Crystallographic Computing School Location: virtual Session Chair: Martin Lutz Session Chair: Claudia Millán The Computing School will cover aspects that are relevant to all fields of crystallographic computing. As the main topic we will focus on the determination and the use of eigenvectors and eigenvalues and their applications in the different fields of crystallography. Applications range from the well known principal component analysis and other statistical and machine learning techniques to modelling using Markov processes, or optimization of functions. Fields such as image processing, information theory, and crystallography make use of these in many of its most fundamental methods. It impacts directly macromolecular crystallography in both phasing and refinement aspects. In small molecule crystallography and materials science research, it allows the understanding of very fundamental physical properties of matter. In this school, our aim is to learn and teach about this general topic from the computing aspect of the fundamentals, but also the computing tools and the data. |
| 2:00pm - 8:00pm | School - ePDF 2: School on electron PDF (pair-distribution function) Session Chair: Tatiana Gorelik virtual meeting |
| Date: Friday, 03/Sept/2021 | |
| 2:00pm - 8:00pm | School - Computing 3: Crystallographic Computing School Location: virtual Session Chair: Martin Lutz Session Chair: Claudia Millán The Computing School will cover aspects that are relevant to all fields of crystallographic computing. As the main topic we will focus on the determination and the use of eigenvectors and eigenvalues and their applications in the different fields of crystallography. Applications range from the well known principal component analysis and other statistical and machine learning techniques to modelling using Markov processes, or optimization of functions. Fields such as image processing, information theory, and crystallography make use of these in many of its most fundamental methods. It impacts directly macromolecular crystallography in both phasing and refinement aspects. In small molecule crystallography and materials science research, it allows the understanding of very fundamental physical properties of matter. In this school, our aim is to learn and teach about this general topic from the computing aspect of the fundamentals, but also the computing tools and the data. |
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