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1 X-ray Crystallography Tim Royappa Department of Chemistry…
https://www.ccdc.cam.ac.uk/media/X-ray-crystallography-exercise-teaching-subset.pdf17 Jan 2023: 1. X-ray Crystallography Tim Royappa. Department of Chemistry University of West Florida. Introduction When X-rays strike a crystal, they are diffracted by the ordered atoms in the crystal, via elastic scattering from the electrons. Measurements of -
Introduction to the CSD Python API (PYAPI-001) 2023.1 CSD ...
https://www.ccdc.cam.ac.uk/media/Introduction-to-API.pdf23 Jun 2023: Materials. For this workshop you will need the file example.cif that you can download here. ... https://visualstudio.microsoft.com/downloads/). PYAPI-001. 4. Example 1: Demonstrating Input and Output. Aim. This example will focus on understanding the -
Exercises
https://www.ccdc.cam.ac.uk/media/resources/practiceproblems_george_sheldrick.docx17 Jan 2023: Exercises. Please read - If you intend to use this resource in a classroom setting, you must agree to cite George Sheldrick, Georg-August-Universität Göttingen. Contents Exercises 1 1. Symmetry Elements 1 2. Symmetry, Point Groups 1 3. Unit cells, -
Crystals of Sugar This activity will introduce you to ...
https://www.ccdc.cam.ac.uk/media/Crystals_of_Sugar.pdf17 Jan 2023: Plate (2). Saucepan. Tall, cylindrical glasses/ jars. Clothing pegs. Stove. You can download and print the activity worksheet or follow along on a device. -
Exercises
https://www.ccdc.cam.ac.uk/media/resources/MZ-Exercises.docx17 Jan 2023: Exercises. Please read - If you intend to use this resource in a classroom setting, you must agree to cite Mike Zdilla, Temple University. Answers to the exercises are available upon request. Contents Exercises 1 1a. Unit Cells 1 1b. Unit Cells 2 -
1 A short guide to Crystallographic Information Files A ...
https://www.ccdc.cam.ac.uk/media/MoreInformationAboutCIFsyntax.pdf28 Mar 2023: 1. A short guide to Crystallographic Information Files A CIF or Crystallographic Information File is the standard format for storing crystallographic structural. data. CIF information has a specific structure or format that needs to be followed to -
Table of Contents Introduction…
https://www.ccdc.cam.ac.uk/media/Documentation/75D6F5FC-8B6E-4795-BDCC-67A3300639A6/CSD-CrossMiner-tutorial-4-features-database.pdf17 Jan 2023: our Downloads page. The supplied feature database contains a subset of the CSD and PDB. ... Note that the speed of the download depends on the quality of your network. -
PowerPoint Presentation
https://www.ccdc.cam.ac.uk/media/csdu-csd-python-api-101-slides.pdf17 Jan 2023: Download, use, edit, and sharescripts with the community. https://github.com/ccdc-opensource/csd-python-api-scripts. CSD Python API: Interface. • -
Table of Contents Introduction…
https://www.ccdc.cam.ac.uk/media/Subset-search-ConQuest.pdf19 Jun 2023: Table of Contents Introduction. 2. Learning Outcomes. 2. Pre-required Skills. 2. Materials. 2. Loading subsets. 3. Restricting searches to a subset. 4. Conclusions. 5. Exercises. 6. Summary. 6. Next Steps. 6. Feedback. 6. Glossary. 7. Review. -
1 Note: the image above has the only scope ...
https://www.ccdc.cam.ac.uk/media/SymmetryOperations-and-PoinGroups_Worksheet.pdf17 Jan 2023: 1 Note: the image above has the only scope to provide an example of the operation and element of immediate visualisation, even though the result of the operation does not make the molecule appear same as before. σ. σ. σ σ σ. σ. σh. •. •.
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