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1 - 50 of 565 search results for download |u:www.ccdc.cam.ac.uk

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  2. Community Outreach in Structural Science | CCDC

    https://www.ccdc.cam.ac.uk/community/education-and-outreach/outreach/community-projects/
    11 May 2024: Download the poster here.

  3. Script Licence V1 | CCDC

    https://www.ccdc.cam.ac.uk/script-licence-v1/
    11 May 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.

  4. GOLD docking in API – ligand flexibility, water handling and more |…

    https://www.ccdc.cam.ac.uk/discover/blog/gold-docking-python-api/
    11 May 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.

  5. Exercises

    https://www.ccdc.cam.ac.uk/media/resources/MZ-Exercises.docx
    17 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

  6. CSD Structures in Elsevier's COVID-19 collection | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/2020-03-24-csd-structures-in-elseviers-covid-19-collection/
    11 May 2024: These are available to download for free for text and data mining.

  7. Solid Form Health Check | CCDC

    https://www.ccdc.cam.ac.uk/consultancy-services/scientific-consultancy/solid-form-health-check/
    11 May 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.

  8. Table of Contents Introduction…

    https://www.ccdc.cam.ac.uk/media/Documentation/2F172476-D4B5-4C18-AED9-165EB29C665A/using-subsets-in-conquest.pdf
    17 Jan 2023: Table of Contents Introduction. 2. Objectives. 2. Pre-required skills. 2. Materials. 2. Loading subsets. 3. Restricting searches to a subset. 4. Conclusions. 5. Further Exercises. 6. Conclusions. 6. Next steps. 6. Feedback. 6. Glossary. 7. Review.

  9. Fluorine | CCDC

    https://www.ccdc.cam.ac.uk/elements/fluorine/
    11 May 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.

  10. Countdown to 1 million | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/countdown_to_1_million/
    11 May 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.

  11. Bespoke Training | CCDC

    https://www.ccdc.cam.ac.uk/consultancy-services/bespoke-training/
    11 May 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.

  12. CSD-Educators: Marielle Agbahoungbata from X-TechLab in Benin | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/csd-educators-marielle-agbahoungbata/
    11 May 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.

  13. 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.

  14. Table of Contents Purpose of Docking…

    https://www.ccdc.cam.ac.uk/media/Documentation/EE9787F1-9256-4A91-8264-95371DCD8008/GOLD-tutorial-Flexibility-Constraints.pdf
    17 Jan 2023: Please download the example files for this tutorial. You will balance flexibility and constraints in two separate docking experiments trying to predict the poses of:. • ... confidence about key interactions. Download Input Files examples. 6. Your

  15. Virtual screening with the GOLD Cluster Computing package | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/virtual-screening-gold-cluster/
    11 May 2024: Installation or downloads needed:. Download the GOLD Cluster Computing package (see link below) and extract it in a suitable location on the cluster. ... The GOLD Cluster and Cloud products will be available for you to access at the following

  16. Teaching and Learning

    https://www.ccdc.cam.ac.uk/solutions/by-field/teaching/
    11 May 2024: Learn More. Download Free CSD Software and Data. Explore the CSD-Community free data and software collection, and download it to get started today.

  17. Scientific Data Preservation Policy | CCDC

    https://www.ccdc.cam.ac.uk/about-us/accreditation-and-policies/scientific-data-preservation-policy/
    11 May 2024: Data Consumers can then view, download and interact with the data directly in the web browser free of charge. ... This includes all individuals who interact, view, or download data via CCDC online services.

  18. Apply for FAIRE | CCDC

    https://www.ccdc.cam.ac.uk/community/ccdc-for-the-community/faire-grants/apply-for-faire/
    11 May 2024: The CCDC – We will email you the activation keys for you and your institution, and links and instructions to download, install and activate the CSD. ... You – Share the keys with your colleagues and students, so your institution can download and

  19. Samarium | CCDC

    https://www.ccdc.cam.ac.uk/elements/samarium/
    11 May 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.

  20. Solid Form Science | CCDC

    https://www.ccdc.cam.ac.uk/research/solid-form/
    11 May 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.

  21. I am not a number – a potted history of the CSD refcode | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/post-20/
    11 May 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.

  22. Structural Chemistry Teaching Resources | CCDC

    https://www.ccdc.cam.ac.uk/community/education-and-outreach/education/teaching-modules/
    11 May 2024: Download Introduction to Optical Isomerism and Chirality Module. Download Introduction to Symmetry Operations and Point Groups Module. ... Download Introduction to Crystallography Exercise. The Cambridge Crystallographic Data Centre. 12 Union Road.

  23. Krypton | CCDC

    https://www.ccdc.cam.ac.uk/elements/krypton/
    11 May 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.

  24. Travel Directions TrainCambridge station is a ten minute walk ...

    https://www.ccdc.cam.ac.uk/media/CCDC_travel_directions_2024.pdf
    30 Jan 2024: Travel Directions. TrainCambridge station is a ten minute walk away f rom the CCDC. There are direct trains f rom London which take about one hour; and London Stansted Airport which take about 35 minutes. Most trains f rom the North and Midlands

  25. FIMs 101 | CCDC

    https://www.ccdc.cam.ac.uk/community/training-and-learning/csdu-modules/fims-101/
    11 May 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.

  26. Insights into drug-like compounds from crystal data | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/insights-into-drug-like-compounds-from-crystal-data/
    11 May 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.

  27. Thousands of New Structures Added to the CSD | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/thousands-of-new-structures-added-to-the-csd/
    11 May 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.

  28. Manganese | CCDC

    https://www.ccdc.cam.ac.uk/elements/manganese/
    11 May 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.

  29. Cerium | CCDC

    https://www.ccdc.cam.ac.uk/elements/cerium/
    11 May 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.

  30. CrystEngComm celebrates the CSD in a special issue | CCDC

    https://www.ccdc.cam.ac.uk/discover/news/crystengcomm-special-csd-issue/
    11 May 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.

  31. Protactinium | CCDC

    https://www.ccdc.cam.ac.uk/elements/protactinium/
    11 May 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.

  32. Python API 101 | CCDC

    https://www.ccdc.cam.ac.uk/community/training-and-learning/csdu-modules/python-api-101/
    11 May 2024: The slides are available here and you can also download the scripts written during the demo here.

  33. Dubnium | CCDC

    https://www.ccdc.cam.ac.uk/elements/dubnium/
    11 May 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.

  34. Teaching Tutorial - Hydrogen bond Definition, examples, special cases …

    https://www.ccdc.cam.ac.uk/media/Teaching-Tutorial-Hydrogen-Bond.pdf
    17 Jan 2023: Teaching Tutorial. -. Hydrogen bond Definition, examples, special cases. Course of. General and Inorganic Chemistry. Author:. Stefano Canossa. Reviewed by. Prof. Alessia Bacchi. Università degli Studi di Parma,. Dipartimento di Chimica. Teaching

  35. Lanthanum | CCDC

    https://www.ccdc.cam.ac.uk/elements/lanthanum/
    11 May 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.

  36. CCDC Webinar: The Role of Quality Data in Advancing AI and ML in Life …

    https://www.ccdc.cam.ac.uk/community/events/webinars/ccdc-webinar-the-role-of-quality-data-in-advancing-ai-and-ml-in-life-sciences/
    11 May 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.

  37. Searching and Analysing Structural Data | CCDC

    https://www.ccdc.cam.ac.uk/solutions/software/csd-python/
    11 May 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.

  38. How to Analyse Hydrogen Bonding | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/how-to-analyse-hydrogen-bonding-in-silico/
    11 May 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.

  39. Pharmaceutical Software

    https://www.ccdc.cam.ac.uk/solutions/by-field/pharmaceutical/
    11 May 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.

  40. 1 Company Number 2155347 THE COMPANIES ACT 2006 COMPANY ...

    https://www.ccdc.cam.ac.uk/media/Articles-of-Association.pdf
    28 Jun 2023: 1. Company Number 2155347. THE COMPANIES ACT 2006. COMPANY LIMITED BY GUARANTEE AND. NOT HAVING A SHARE CAPITAL. ARTICLES OF ASSOCIATION. - of-. THE CAMBRIDGE CRYSTALLOGRAPHIC DATA CENTRE. (as adopted by Special Resolution passed on 5th May 2023). 2.

  41. ConQuest in Action: UBE Industries and Santen Pharmaceutical Co.…

    https://www.ccdc.cam.ac.uk/discover/blog/ep2-selective-receptor-agonist-scaffold-for-treatment-of-glaucoma/
    11 May 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.

  42. CSD-Community Workshops | CCDC

    https://www.ccdc.cam.ac.uk/community/training-and-learning/workshop-materials/csd-community-workshops/
    11 May 2024: Download material. or try the CSDU module Visualization 101 – Visualizing structural chemistry data with Mercury). ... Workshop code: MER-005. Download material. The Cambridge Crystallographic Data Centre. 12 Union Road.

  43. 1 A short guide to Crystallographic Information Files A ...

    https://www.ccdc.cam.ac.uk/media/MoreInformationAboutCIFsyntax.pdf
    28 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

  44. Guide to CIFs | CCDC

    https://www.ccdc.cam.ac.uk/community/access-deposit-structures/deposit-a-structure/guide-to-cifs/
    11 May 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.

  45. 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.

  46. Getting the most from your academic CSD licence | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/getting-the-most-from-your-academic-csd-licence/
    11 May 2024: While users will still need to download and install the CSD releases, the software will work with any version.

  47. Titanium | CCDC

    https://www.ccdc.cam.ac.uk/elements/titanium/
    11 May 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.

  48. PowerPoint Presentation

    https://www.ccdc.cam.ac.uk/media/csdu-csd-python-api-101-slides.pdf
    17 Jan 2023: Download, use, edit, and sharescripts with the community. https://github.com/ccdc-opensource/csd-python-api-scripts. CSD Python API: Interface. •

  49. Search, Visualize and Analyse Known Small Molecules

    https://www.ccdc.cam.ac.uk/solutions/by-use-case/search-known-small-molecules/
    11 May 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.

  50. Benefits of Data Sharing | CCDC

    https://www.ccdc.cam.ac.uk/community/access-deposit-structures/deposit-a-structure/benefits-of-data-sharing/
    11 May 2024: The majority of these structures were determined prior to the pandemic, but the views and downloads for the relevant structures in the CSD increased dramatically after 2019. ... For example, Remdesivir (CSD refcode ZARNAK) was published in 2017, but over

  51. Self-Guided Workshop Materials | CCDC

    https://www.ccdc.cam.ac.uk/community/training-and-learning/workshop-materials/
    11 May 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.

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