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, 01:38:05am CET

 
 
Session Overview
Session
Poster - 54 Methods: Methods
Time:
Saturday, 21/Aug/2021:
5:10pm - 6:10pm


Date and time of the session to be determined.


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Presentations
ID: 1981 / Poster - 54 Methods: 1
Poster session abstracts
Poster

Poster session abstracts

Radomír Kužel



ID: 1504 / Poster - 54 Methods: 2
Methods and instruments
Poster
Posters only: Methods, instrumentation (if it does not fit to any specific topics)
Keywords: High resolution, high quality, validation and reproducibility in structural science, X-ray diffraction

Advances in the Parameter Space Concept for Crystal Structure Determination – a maximum resolution study

Matthias Zschornak1,2, Christian Wagner1,2, Melanie Nentwich3, Dirk C. Meyer1, Karl Fischer4

1TU Bergakademie Freiberg, Institut für Experimentelle Physik, Leipziger Str. 23, D-09599 Freiberg, Germany; 2TU Chemnitz, Institut für Physik, Reichenhainer Str. 70, D-09126 Chemnitz, Germany; 3DESY Photon Science, Notkestr. 85, D-22607 Hamburg, Germany; 4Universität des Saarlandes, Experimentalphysik, Campus A5 1, D-66041 Saarbrücken, Germany

External Resource:
Video Link


ID: 1494 / Poster - 54 Methods: 3
Poster sessions
Poster
Posters only: Methods, instrumentation (if it does not fit to any specific topics)
Keywords: cocrystal, high-pressure CO2, lipid-mediated

High-pressure CO2 for lipid-mediated cocrystallization of theophylline and nicotinamide

Yuna Tatsumi, Yingquan Hao, Yusuke Shimoyama

Tokyo Institute of Technology, Tokyo, Japan

External Resource:
Video Link


ID: 1350 / Poster - 54 Methods: 4
Theory, computation, modelling, data, standards
Poster
MS: Crystal structure prediction, Advanced methods for analysis of XAFS and crystallographic data, Data-driven discovery in crystallography
Posters only: Theory, computation, modeling, data, standards (if it does not fit to any specific topics)
Keywords: grazing-incidence X-ray diffraction; indexing; crystallographic unit cell; software

GIDInd: an automated indexing software for grazing-incidence X-ray diffraction data

Manuel P. Kainz2, Lukas Legenstein2, Valentin Holzer2, Sebastian Hofer2, Martin Kaltenegger2, Roland Resel2, Josef Simbrunner1

1Graz Medical University, Graz, Austria; 2Graz Technical University, Graz, Austria

External Resource:
Video Link


ID: 1457 / Poster - 54 Methods: 5
Methods and instruments
Poster
MS: Structure solution and poorly crystalline materials, Crystallization mechanisms of small molecule systems, Combining X-ray diffraction and spectroscopy to characterise materials, Combination of X-ray and electrons for structure characterization, 4th generation SR and XFEL Facilities, XAS and crystallography allied for geomaterials and environmental problems, Application of electron crystallography to functional materials, Diffraction imaging, grain mapping in materials and art
Posters only: Methods, instrumentation (if it does not fit to any specific topics), General (if it does not fit to any specific topics nor areas)
Keywords: Sample delivery, Automation, Machine Vision

Towards real-time analysis of liquid jet alignment in SFX

Jaydeep Patel1, Adam Round2, Andrew Peele3, Adrian Mancuso2, Brian Abbey1

1La Trobe University; 2European XFEL; 3Australian Synchrotron (ANSTO)

External Resource:
Video Link


ID: 1353 / Poster - 54 Methods: 6
Theory, computation, modelling, data, standards
Poster
MS: Beyond pure point diffraction: Theory and application of diffuse scattering, Crystal structure prediction, Advanced methods for analysis of XAFS and crystallographic data
Posters only: Theory, computation, modeling, data, standards (if it does not fit to any specific topics), General (if it does not fit to any specific topics nor areas)
Keywords: organic epitaxy; GIXD; indexing; polymorphism

An efficient method for indexing grazing-incidence X-ray diffraction data of epitaxially grown thin films

Josef Simbrunner1, Benedikt Schrode2, Jari Domke3, Torsten Fritz3, Roman Forker3, Roland Resel2

1Graz Medical University, Graz, Austria; 2Graz Technical University, Graz, Austria; 3Friedrich Schiller University Jena, Jena, Germany

External Resource:
Video Link


ID: 1556 / Poster - 54 Methods: 7
Methods and instruments
Poster
Posters only: Methods, instrumentation (if it does not fit to any specific topics)
Keywords: X-ray crystallography, Spectroscopy, Raman, UV-Visible absorption

Development of microspectrophotometer for the macromolecular crystallography beamline at the Photon Factory, Japan

Masahide Hikita1, Yusuke Yamada1, Naohiro Matsugaki1, Masahiko Hiraki2, Toshiya Senda1

1Structural Biology Research Center, High Energy Accelerator Research Organization; 2Mechanical Engineering Center, High Energy Accelerator Research Organization

External Resource:
Video Link


ID: 1407 / Poster - 54 Methods: 8
Methods and instruments
Poster
MS: Advanced methods for analysis of XAFS and crystallographic data
Posters only: Methods, instrumentation (if it does not fit to any specific topics)
Keywords: high-strength hydrogels; protein crystallization; dialysis membrane

Growth of protein crystals in high-strength hydrogels with the dialysis membrane

Taichi Naruse1, Kenta Hamada1, Hiroaki Adachi2, Tsugio Nagasawa3, Noriaki Kunimune3, Michio Murata4, Yusuke Mori5, Shigeru Sugiyama1

1Faculty of Science & Technology, Kochi University, Kochi, Japan; 2SOSHO Inc., Osaka, Japan; 3Kunimune Corp., Osaka; 4Graduate School of Science, Osaka University, Osaka, Japan; 5Graduate School of Engineering, Osaka University, Osaka, Japan

External Resource:
Video Link


ID: 1601 / Poster - 54 Methods: 9
Poster sessions
Poster
Posters only: Theory, computation, modeling, data, standards (if it does not fit to any specific topics)
Keywords: single crystal diffraction; neutron; visualization software;

Development of Reciprocal Space Mapping Software for Single Crystal Diffraction

Yoshihisa Ishikawa1, Ryoji Kiyanagi2, Takashi Ohhara2, Akiko Nakao1, Koji Munakata1, Kentaro Moriyama1, Yukio Noda3

1Comprehensive Research Organization for Science and Society, Tokai, Ibaraki, Japan; 2J-PARC center, Japan Atomic Energy Agency, Ibaraki, Japan; 3IMRAM Tohoku University, Sendai, Miyagi, Japan.

External Resource:
Video Link


ID: 1694 / Poster - 54 Methods: 10
Chemical crystallography, crystal structures
Poster
Posters only: Chemical crystallography, crystal structures (if it does not fit to any specific topics)
Keywords: crystal structure analyses, problem solving, single crystal

Identifying problems in your single crystal diffraction data

Richard I. Cooper, David J. Watkin

University of Oxford, Oxford, United Kingdom

External Resource:
Video Link


ID: 1882 / Poster - 54 Methods: 11
Theory, computation, modelling, data, standards
Poster
Posters only: Theory, computation, modeling, data, standards (if it does not fit to any specific topics)
Keywords: atom; centrosymmetric cubic space group; sharpening.;

Application of result of atoms and centrosymmetric cubic space groups for sharpening of Patterson function

Pui Sum Yuen

Nil, HONG KONG, Hong Kong S.A.R. (China)

External Resource:
Video Link


ID: 1883 / Poster - 54 Methods: 12
Theory, computation, modelling, data, standards
Poster
Posters only: Theory, computation, modeling, data, standards (if it does not fit to any specific topics)
Keywords: initial phases; random phases; approximate structure;

An attempt to find the use of atomic scattering factors and centrosymmetric cubic space groups; two choices of random phases in direct methods

Pui Sum Yuen

Nil, HONG KONG, Hong Kong S.A.R. (China)

External Resource:
Video Link


 
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