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  2. CHM2320_Sp16_MercuryIntroduction.pages

    https://www.ccdc.cam.ac.uk/media/Metal-Organic-Intro.pdf
    17 Jan 2023: This database contains over 500 structures and can be accessed from the Database menu by choosing Database > Open the Teaching Subset. ... Once this database is open, you should see the accession codes for the crystal structures shown in the Structure
  3. 1 Note: the image above has the only scope ...

    https://www.ccdc.cam.ac.uk/media/SymmetryOperations-and-PoinGroups_Worksheet.pdf
    17 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. •. •.
  4. IYPT Crystals BattlecardsAges 8+ For 2+ players To mark ...

    https://www.ccdc.cam.ac.uk/media/IYPTCrystals_Battlecards_Rules_0.pdf
    17 Jan 2023: The images present on the cards were realised using Mercury. A f ree version of this software is available to download f rom the CSD Community webpage. ... This is a community led project involving volunteer contributors throughout the crystallographic
  5. Teaching Tutorial - Hydrogen bond Definition, examples, special cases …

    https://www.ccdc.cam.ac.uk/media/Teaching-Tutorial-Hydrogen-Bond.pdf
    17 Jan 2023: Following this convention, we. represent the hydrogen bond with a dotted line, as follows:. ... can call “XI”. By expanding this concept, we can think of hydrogen bond chains connecting different molecules.
  6. 1 Table of Contents Try – it’s your turn! ...

    https://www.ccdc.cam.ac.uk/media/CSDU-Mogul101-Try.pdf
    17 Jan 2023: Materials For this workshop we will use the file 1JR1_ligand.pdb that you can download from this link. ... Double-. click this line to bring up the data from the Mogul library.
  7. IYPT Crystals BattlecardsAges 8+ For 2+ players To mark ...

    https://www.ccdc.cam.ac.uk/media/elements/activities/iyptcrystals_battlecards_rules_0.pdf
    17 Jan 2023: The images present on the cards were realised using Mercury. A f ree version of this software is available to download f rom the CSD Community webpage. ... This is a community led project involving volunteer contributors throughout the crystallographic
  8. Table of Contents Try – it’s your turn!…

    https://www.ccdc.cam.ac.uk/media/GOLD-101_handout-1.pdf
    17 Jan 2023: Materials For this workshop we will use the files that you can download from here. ... Provided Input Files. Please download and unzip the input files from this link.
  9. Table of Contents Protein-ligand docking with GOLD…

    https://www.ccdc.cam.ac.uk/media/Intro-Protein-Ligand-Docking-GLD-001.pdf
    17 Jan 2023: Materials For this workshop we will use the files that you can download from here. ... Provided Input Files. Please download and unzip the input files from this link.
  10. MOG-001 1 Table of Contents Introduction…

    https://www.ccdc.cam.ac.uk/media/Documentation/86E7457F-D9A2-4DA4-99C3-37B79E9C8960/HG-Mogul.pdf
    17 Jan 2023: Materials For this workshop we will use the file 1JR1_ligand.pdb that you can download. ... from this link. Example of the Mogul geometry assessment interface. MOG-001 3.
  11. Programmatic access to the CSD using the CSD Python ...

    https://www.ccdc.cam.ac.uk/media/csdu-csd-python-api-101-try.pdf
    17 Jan 2023: Materials. For this workshop you will need the file example.cif that you can download here. ... accessing the underlying molecule from this entry. Add. these lines to your script:.

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