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  2. CSD MOF Collection | CCDC

    https://www.ccdc.cam.ac.uk/free-products/csd-mof-collection/
    5 Jul 2024: Learn more and download it here. ... Download the collection here – you will need to provide a current email address and agree to the licence.
  3. Crystal Structure Visualisation with | CCDC

    https://www.ccdc.cam.ac.uk/solutions/software/free-mercury/
    5 Jul 2024: See a complete and up-to-date list of file types Mercury supports here..
  4. Download CSD Data and Software | CCDC

    https://www.ccdc.cam.ac.uk/support-and-resources/download-the-csd/
    5 Jul 2024: Downloads. You can download CSD data and software to your machine from this page.
  5. CellCheckCSD released: a new service for performing automated reduced …

    https://www.ccdc.cam.ac.uk/discover/news/post-12-2/
    5 Jul 2024: Learn more about CellCheckCSD and download it free of charge here..
  6. Python API 101 | CCDC

    https://www.ccdc.cam.ac.uk/community/training-and-learning/csdu-modules/python-api-101/
    5 Jul 2024: The slides are available here and you can also download the scripts written during the demo here. ... Leave your feedback here – it takes less than 5 minutes.
  7. Reciprocal lattice worksheet

    https://www.ccdc.cam.ac.uk/media/resources/mzl0.doc
    17 Jan 2023: Lab Final handout – Crystal Growth. Crystallography and Diffraction. Prof. Zdilla, Spring. Methods of Crystal Growth. In this lab, we will attempt to grow X-ray diffraction quality crystals. Recrystalization methods normally use two types of
  8. Free Products and Services | CCDC

    https://www.ccdc.cam.ac.uk/free-products/
    5 Jul 2024: You can download and use, or modify the scripts here, and share your scripts with the community!
  9. Latest Updates in CCDC Software and Data | CCDC

    https://www.ccdc.cam.ac.uk/solutions/whats-new/
    5 Jul 2024: the Downloads page here, and this download will contain the latest data update. ... On-Site WebCSD users will need to go to CCDC’s opensource GitHub repository here.
  10. Download scripts for the CSD Python API from the CSD GitHub…

    https://www.ccdc.cam.ac.uk/discover/blog/download-csd-python-api-scripts-github/
    5 Jul 2024: Access the CSD GitHub repository here to download, edit and submit scripts for the CSD Python API. <<. ... To download 1 set of scripts from the CSD GitHub repo, follow the instructions here..
  11. Licensing Information | CCDC

    https://www.ccdc.cam.ac.uk/support-and-resources/licensing-information/
    5 Jul 2024: Licensing FAQs. How do I download and install the free version of Mercury? ... You can download Mercury for Windows, Linux or MacOS from the CSDS Downloads page.
  12. Community Outreach in Structural Science | CCDC

    https://www.ccdc.cam.ac.uk/community/education-and-outreach/outreach/community-projects/
    5 Jul 2024: Here are resources and ideas from engagement projects created by members of the community with the support of the CCDC Engagement Grants. ... Download the poster here.
  13. Free Crystal Structure Reduced Cell Checks | CCDC

    https://www.ccdc.cam.ac.uk/solutions/software/cellcheckcsd/
    5 Jul 2024: Solutions. Back. Solutions. By Field. By Use Case. By Suite. Software. Software Integrations. Community. Back. Community. Access/Deposit Structures. CCDC for the Community. Partnerships and Initiatives. Education and Outreach. Training and Learning.
  14. Classifying metal-organic frameworks MOFs for search and screening |…

    https://www.ccdc.cam.ac.uk/discover/blog/mof-classification-search-screen/
    5 Jul 2024: Read the full paper here, or learn more about the CSD (including the proportion of MOF structures it contains) here. ... Learn more and download here.
  15. Table of Contents Introduction…

    https://www.ccdc.cam.ac.uk/media/Introduction-to-IsoStar.pdf
    13 Jun 2023: PDB? 12. Go back to the IsoStar website and download the phenyl group information. ... Exercises • Download the IsoStar CSD data for the interaction of a charged pyridine ring.
  16. CSD-Core Workshops | CCDC

    https://www.ccdc.cam.ac.uk/community/training-and-learning/workshop-materials/csd-core-workshops/
    5 Jul 2024: Download material. Workshop code: CQ-004. Download material. Workshop code: CQ-005. Download material. ... Workshop code: CQ-006. Download material. A translated version of the Introduction to WebCSD in Russian can be found here.
  17. 2022 CSD Releases | CCDC

    https://www.ccdc.cam.ac.uk/solutions/whats-new/2022-csd-releases/
    5 Jul 2024: To get the update, use the auto-update function in Mercury, or download the CSD here. ... To get the update, use the auto-update function in Mercury, or download the CSD here.
  18. Understanding solid form stability with Hydrogen Bond Statistics |…

    https://www.ccdc.cam.ac.uk/discover/blog/solid-form-stability-hydrogen-bond-statistics/
    5 Jul 2024: Here we explain how Hydrogen Bond Statistics works. How to assess solid form stability.
  19. DECOR | CCDC

    https://www.ccdc.cam.ac.uk/community/education-and-outreach/education/decor/
    5 Jul 2024: Online Courses. View Resource. Online Courses. Access various crystallography online courses here. ... Read his blog on the creation of DECOR here.
  20. Table of Contents UTry – it’s your…

    https://www.ccdc.cam.ac.uk/media/WebCSD_CSDU_UTry.pdf
    25 Jan 2024: Please contact your site administrator for further information. Materials Download the MOL file for nirmatrelvir here. ... Download the MOL file from here if you have not already done so.
  21. 2021 CSD Releases | CCDC

    https://www.ccdc.cam.ac.uk/solutions/whats-new/2021-csd-releases/
    5 Jul 2024: Here you can find the CSD data updates and software releases from 2021. ... Please note this is not included in the CSD-Enterprise package – see more here.
  22. Boosting Research Efficiency in Industry with FAIR Data | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/boosting-research-efficiency-in-industry-with-fair-data/
    5 Jul 2024: In today’s blog, based on the webinar ‘Boosting Research Efficiency in Industry with FAIR Data’ (download the recording here), the FAIR data principles and their potential is discussed.
  23. What's the difference between free Mercury and full-licence…

    https://www.ccdc.cam.ac.uk/discover/blog/the-difference-between-free-mercury-and-full-licence-mercury/
    5 Jul 2024: Here we explain the differences between the free and paid licence versions of Mercury. ... Or, if you don’t need all functions, for internal research, development or teaching download the free version of Mercury through CSD-Community here.
  24. How scientists can support COVID-19 research from home | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/2020-03-24-how-scientists-can-support-covid-19-research-from/
    5 Jul 2024: Here we list collaborative projects which you can contribute to – even if you’re working from home. ... If you know about another project not listed here please email us at.
  25. Enhancing the Discoverability and Value of Crystal Structural Data –…

    https://www.ccdc.cam.ac.uk/discover/blog/enhancing-the-discoverability-and-value-of-crystal-structural-data-the-csd-data-curation-process/
    5 Jul 2024: This blog, based on the webinar ‘The CSD Data Curation Process’ (download the recording here) discusses how the experimental data is further curated to enhance the discoverability and value of the ... More information on how to deposit data in the
  26. Table of Contents Introduction…

    https://www.ccdc.cam.ac.uk/media/Introduction-to-Hermes.pdf
    13 Jun 2023: Materials For this workshop we will use the files that you can download from here. ... Here the ligand is coloured such that carbon atoms are green (Custom Carbon…) but all heteroatoms are their normal (by element) colours.
  27. 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.
  28. Introduction to the CSD Python API (PYAPI-001) 2023.1 CSD ...

    https://www.ccdc.cam.ac.uk/media/Introduction-to-API.pdf
    23 Jun 2023: Materials. For this workshop you will need the file example.cif that you can download here. ... the CSD entry AABHTZ. Here we are editing the script to simply read out some further attributes.
  29. 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.
  30. 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: experimental structures as they are to the examples shown here using entries in the Cambridge. ... Materials. For this workshop you will need the file example.cif that you can download here.
  31. Table of Contents Ensemble Docking…

    https://www.ccdc.cam.ac.uk/media/Documentation/0D5504D3-81F2-46D3-9D1D-16787D07F70B/GOLD-tutorial-EnsembleDocking.pdf
    17 Jan 2023: not treat the set in any kind of ‘averaged’ capacity. Please download the tutorial input files here. ... binding site definition. It can help here to switch off the display H-atoms.
  32. Table of Contents Docking with Water in the Binding ...

    https://www.ccdc.cam.ac.uk/media/Documentation/4DDADBC4-A645-4E44-AD37-73D09F04C298/GOLD-DockingWater-tutorial.pdf
    17 Jan 2023: Materials For this workshop we will use the files that you can download from here. ... Here, we will illustrate the requirements for setting up and running docking with active water.
  33. Introduction to the CSD Python API (PYAPI-001) 2020.3 CSD ...

    https://www.ccdc.cam.ac.uk/media/Documentation/6AA69486-FA98-4182-84F9-50A586CC0B04/CSD-Python-API-workshop.pdf
    17 Jan 2023: Materials. For this workshop you will need the file example.cif that you can download here. ... the CSD entry AABHTZ. Here we are editing the script to simply read out some further attributes.
  34. Table of Contents Introduction…

    https://www.ccdc.cam.ac.uk/media/Documentation/E8327590-2CDF-40AF-8092-28B67E58BE72/Ligand_Based_Virtual_Screening_Tutorial.pdf
    17 Jan 2023: and enrichment metrics will be calculated. Please download the example files here. ... so far, this is not appropriate. Here we will generate some possible overlays.

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