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201 - 250 of 500 search results for `Download the data` |u:www.ccdc.cam.ac.uk

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  2. BioChemGRAPH project will improve data synergy to facilitate drug…

    https://www.ccdc.cam.ac.uk/discover/news/biochemgraph-project/
    18 Jul 2024: A collaboration announced today will see the integration of key structural, functional, and biochemical data across both small molecules and macromolecules. ... The three databases are seen as leaders in their respective fields, known and trusted for

  3. By Use Case | CCDC

    https://www.ccdc.cam.ac.uk/solutions/solutions-by-use-case/
    18 Jul 2024: Used by 9 of the top 10 pharmaceutical companies globally, as well as a growing number of start-ups and biotechs, our crystallographic data tools help you do your best work. ... Use Cases We Serve. The Cambridge Crystallographic Data Centre. 12 Union Road

  4. CSD-Leaderboard | CCDC

    https://www.ccdc.cam.ac.uk/community/csd-leaderboard/
    18 Jul 2024: You must have published data in the CSD during the last year which has been curated into the latest CSD release. ... Learn more about the CSD. The Cambridge Crystallographic Data Centre. 12 Union Road.

  5. Particle Science | CCDC

    https://www.ccdc.cam.ac.uk/research/particle-science/
    18 Jul 2024: Selected Publications. The Cambridge Crystallographic Data Centre. 12 Union Road. Cambridge. ... Cambridge Crystallographic Data Centre, Inc. One Boston Place. Suite 2600. Boston, MA 02108.

  6. CSD Conformer Generator | CCDC

    https://www.ccdc.cam.ac.uk/solutions/software/csd-conformer-generator/
    18 Jul 2024: Discover New Molecules. Unlock Solid Form Innovation. The Cambridge Crystallographic Data Centre. ... Cambridge Crystallographic Data Centre, Inc. One Boston Place. Suite 2600. Boston, MA 02108.

  7. Licensing updates | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/licensing-updates/
    18 Jul 2024: Tags. The Cambridge Crystallographic Data Centre. 12 Union Road. Cambridge. CB2 1EZ. ... Cambridge Crystallographic Data Centre, Inc. One Boston Place. Suite 2600. Boston, MA 02108.

  8. 700,000 high quality crystal structures now at CSD users’ disposal! | …

    https://www.ccdc.cam.ac.uk/discover/blog/post-36/
    18 Jul 2024: spot. WebCSD is frequently updated to include the additional crystal data as it reaches us here in Cambridge. ... CSD X-Press, as the name suggests, contains the most recent data available.

  9. Analyse CSP Results in | CCDC

    https://www.ccdc.cam.ac.uk/solutions/software/csd-theory-web/
    18 Jul 2024: No-one outside your organisation can access the data. Anybody within your organisation can access CSD-Theory web, to aid data sharing and internal discussions. ... Data from the most commonly used CSP providers is compatible, including XtalPi and

  10. CSD ReCore Index | CCDC

    https://www.ccdc.cam.ac.uk/csd-integratable-software/csd-recore-index/
    18 Jul 2024: Hoffmann-La Roche AG (Basel, Switzerland). For more details, please see the original ReCore publication:The Cambridge Crystallographic Data Centre. ... Cambridge Crystallographic Data Centre, Inc. One Boston Place. Suite 2600. Boston, MA 02108.

  11. CellCheckCSD released: a new service for performing automated reduced …

    https://www.ccdc.cam.ac.uk/discover/news/post-12-2/
    18 Jul 2024: The Cambridge Crystallographic Data Centre (CCDC) and Agilent Technologies Inc. (NYSE: A) today announced that CrysAlis. ... Email: admin@ccdc.cam.ac.uk. Phone: 44 1233 336408. The Cambridge Crystallographic Data Centre.

  12. Training and Support Videos | CCDC

    https://www.ccdc.cam.ac.uk/community/training-and-learning/ccdc-videos/
    18 Jul 2024: A step-by-step guide to download the full licence CSD software for structural chemistry visualization and analysis. ... This includes how to download and install Mercury, GOLD, CSD data, and all the other applications.

  13. Who wants to be a millionaire? The CCDC issues number CCDC 900000. |…

    https://www.ccdc.cam.ac.uk/discover/blog/post-14/
    18 Jul 2024: Only then do we add the data to the CSD and make the original data freely available to the public. ... Data weren’t deposited with the CCDC, rather staff here searched the scientific literature for reported structures and painstakingly typed the data

  14. Accreditation and Policies | CCDC

    https://www.ccdc.cam.ac.uk/about-us/accreditation-and-policies/
    18 Jul 2024: The Cambridge Crystallographic Data Centre. 12 Union Road. Cambridge. CB2 1EZ. ... Cambridge Crystallographic Data Centre, Inc. One Boston Place. Suite 2600. Boston, MA 02108.

  15. Technical Consultancy | CCDC

    https://www.ccdc.cam.ac.uk/consultancy-services/technical-consultancy/
    18 Jul 2024: The Cambridge Crystallographic Data Centre. 12 Union Road. Cambridge. CB2 1EZ. ... Cambridge Crystallographic Data Centre, Inc. One Boston Place. Suite 2600. Boston, MA 02108.

  16. Faster, Better Data Deposition Processes Launched | CCDC

    https://www.ccdc.cam.ac.uk/discover/news/post-29-2/
    18 Jul 2024: This will make the process more efficient for depositors, and also ensures the integrity of the data stored at the CCDC for the world’s community of structural chemists. ... The CCDC recognises the importance of structure factors in ensuring the

  17. Scientific Symposium and New Software for Crystallographers and…

    https://www.ccdc.cam.ac.uk/discover/news/post-37-2/
    18 Jul 2024: Batch mode execution. The new update for CSD-System will be available to download from the CCDC website from 6th July 2015. ... About The Cambridge Crystallographic Data Centre. The Cambridge Crystallographic Data Centre is dedicated to the advancement

  18. Functional Materials

    https://www.ccdc.cam.ac.uk/solutions/by-field/functional-materials/
    18 Jul 2024: Explore More. Find out more and keep in touch. The Cambridge Crystallographic Data Centre. ... Cambridge Crystallographic Data Centre, Inc. One Boston Place. Suite 2600. Boston, MA 02108.

  19. Not so Weird and Wonderful? | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/post-57/
    18 Jul 2024: Void space calculations are not part of the data we receive from depositors, but by using the API we can harness the tools in Mercury to run these checks for us ... Senior Scientific Editor. Tags. The Cambridge Crystallographic Data Centre. 12 Union Road.

  20. Manage CSP Landscapes

    https://www.ccdc.cam.ac.uk/solutions/by-use-case/manage-csp-landscapes/
    18 Jul 2024: No one outside your organisation can access the data. Anybody within your organisation can access CSD-Theory Web, to aid data sharing and internal discussions. ... Does the CCDC need access to our in-house data to set up CSD-Theory?

  21. End-to-End Molecular Design

    https://www.ccdc.cam.ac.uk/solutions/by-use-case/end-to-end-molecular-design/
    18 Jul 2024: to maximise the value of the data to your research. ... Included. The Cambridge Crystallographic Data Centre. 12 Union Road. Cambridge. CB2 1EZ.

  22. DOIs assigned to crystal structure datasets in the CSD | CCDC

    https://www.ccdc.cam.ac.uk/discover/news/post-28-2/
    18 Jul 2024: About The Cambridge Crystallographic Data Centre. The Cambridge Crystallographic Data Centre (CCDC) was established in 1965. ... For additional information please contact:. The Cambridge Crystallographic Data Centre. 12 Union Road.

  23. CoreTrustSeal | CCDC

    https://www.ccdc.cam.ac.uk/about-us/accreditation-and-policies/coretrustseal/
    18 Jul 2024: This certification accredits the CCDC with providing trusted stewardship and access to data as judged against criteria established and endorsed by the wider research data community. ... It reinforces and reflects the faith that our depositors and partner

  24. Welcome to CSDU | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/welcome-to-csdu/
    18 Jul 2024: Enjoy CSDU and Visualisation 101! Tags. The Cambridge Crystallographic Data Centre. ... Cambridge Crystallographic Data Centre, Inc. One Boston Place. Suite 2600. Boston, MA 02108.

  25. 2020.3 Release – Introducing New IsoStar Groups | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/new_isostar_groups/
    18 Jul 2024: When IsoStar was first generated we took pragmatic decisions about the groups to include based on data availability at the time. ... You can also join our regular What’s Up webinars for a more in-depth look at new features, where we welcome questions

  26. Macromolecule Hub | CCDC

    https://www.ccdc.cam.ac.uk/solutions/software/macromolecule-hub/
    18 Jul 2024: Access data from the Protein Data Bank, the Cambridge Structural Database, and your in-house database(s). ... There are plans to develop the system further in the future, with the potential to add other data sources including proprietary data.

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

    https://www.ccdc.cam.ac.uk/discover/blog/gold-docking-python-api/
    18 Jul 2024: Tags. The Cambridge Crystallographic Data Centre. 12 Union Road. Cambridge. CB2 1EZ. ... Cambridge Crystallographic Data Centre, Inc. One Boston Place. Suite 2600. Boston, MA 02108.

  28. CSD Linker Database | CCDC

    https://www.ccdc.cam.ac.uk/csd-integratable-software/csd-linker-database/
    18 Jul 2024: The Cambridge Crystallographic Data Centre. 12 Union Road. Cambridge. CB2 1EZ. ... Cambridge Crystallographic Data Centre, Inc. One Boston Place. Suite 2600. Boston, MA 02108.

  29. New Year, New Data Resolutions! | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/data-resolutions/
    18 Jul 2024: New Year Resolutions. The data team at the CCDC are hard at work planning the improvement projects we will undertake for 2021. ... the data in the CSD.

  30. New Architecture for CCDC Data builds Foundation for Greater Insights …

    https://www.ccdc.cam.ac.uk/discover/news/post-23-2/
    18 Jul 2024: More Experimental Data in CSD-Xpedite. CSD-Xpedite enables the CCDC to manage more efficiently the throughput of depositions (including Crystallographic Information Files (CIFs), structure factors, supporting documentation), revised data, data

  31. Collaboration between the CCDC and the IUCr Streamlines…

    https://www.ccdc.cam.ac.uk/discover/news/post-40-2/
    18 Jul 2024: checkCIF report alongside the deposited data to aid peer review of submitted papers. ... Journals that publish small-molecule crystal structures require authors to submit their crystallographic data files to the IUCr’s checkCIF system for validation,

  32. Understand Particle Behaviour

    https://www.ccdc.cam.ac.uk/solutions/by-use-case/understand-particle-behaviour/
    18 Jul 2024: Driven by big-data insights from the world’s database of experimentally determined small-molecule organic crystal structures, and powerful algorithms for molecular analysis. ... Included. The Cambridge Crystallographic Data Centre. 12 Union Road.

  33. Academic Research

    https://www.ccdc.cam.ac.uk/solutions/by-field/academic-research/
    18 Jul 2024: Cambridge Structural Database (CSD) data and software are used by leading academic institutions around the world to support impactful research across chemistry, biochemistry, materials science, agrochemical science, and beyond. ... Included. Research

  34. Teaching Materials for the Classroom | CCDC

    https://www.ccdc.cam.ac.uk/community/education-and-outreach/education/
    18 Jul 2024: Receive updates about training events and resources. The Cambridge Crystallographic Data Centre. ... Cambridge Crystallographic Data Centre, Inc. One Boston Place. Suite 2600. Boston, MA 02108.

  35. CSDU Visualization 101 with Mercury | CCDC

    https://www.ccdc.cam.ac.uk/community/training-and-learning/csdu-modules/visualization-101/
    18 Jul 2024: CSDU Visualization 101 with Mercury. Visualization 101 - Visualizing Structural Chemistry Data with Mercury. ... The Cambridge Crystallographic Data Centre. 12 Union Road. Cambridge. CB2 1EZ.

  36. Self-Guided Workshop Materials | CCDC

    https://www.ccdc.cam.ac.uk/community/training-and-learning/workshop-materials/
    18 Jul 2024: Receive updates about training events and resources. The Cambridge Crystallographic Data Centre. ... Cambridge Crystallographic Data Centre, Inc. One Boston Place. Suite 2600. Boston, MA 02108.

  37. IYPT Crystals Activities | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/iypt-crystals-activities/
    18 Jul 2024: A reward is waiting for you after playing the game! You can ask an adult to download a virtual collectable badge from this No printer? ... The Cambridge Crystallographic Data Centre. 12 Union Road. Cambridge. CB2 1EZ.

  38. The best way to publish your data? | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/2018-06-csdcomm1/
    18 Jul 2024: The best way to publish your data? The best way to publish your data? ... hope to develop mechanisms to allow them to determine if the quality of the data is sufficient for their research.

  39. Fragment Hotspots | CCDC

    https://www.ccdc.cam.ac.uk/open-source-products/fragment-hotspots/
    18 Jul 2024: Protein kinase B and pantothenate synthetase are examined in detail. In each case, the fragment hotspot maps are able to rationalise a Free–Wilson analysis of SAR data from a ... Copyright 2016 American Chemical Society. The Cambridge Crystallographic

  40. CSD-Core – Redefining the heart of the CSD Software Portfolio | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/csd_core_release_blog/
    18 Jul 2024: In the early days, this “CSD System” consisted of just a few programs, such as QUEST for searching, PLUTO for visualisation and GSTAT for data analysis. ... You can also hear more about CSD-Core at our next CCDC Customer Update Webinar in early 2021,

  41. Scientific Consultancy | CCDC

    https://www.ccdc.cam.ac.uk/consultancy-services/scientific-consultancy/
    18 Jul 2024: We take security seriously, and are Cyber Essentials certified. Data-Driven: our consultancy leverages validated experimental data in the CSD, Cambridge Structural Database. ... The Cambridge Crystallographic Data Centre. 12 Union Road. Cambridge. CB2 1EZ

  42. CSD in Action: Data Mining to Find Hydrate–Anhydrate Structure Pairs…

    https://www.ccdc.cam.ac.uk/discover/blog/csd-python-api-data-mining/
    18 Jul 2024: The work shows how the wealth of experimentally validated data in the CSD can be used to test and identify new hypotheses. ... With the data sets defined, the authors looked for trends and found preferences for low numbers of water molecules, odd numbers

  43. On-demand CSDU modules | CCDC

    https://www.ccdc.cam.ac.uk/community/training-and-learning/csdu-modules/
    18 Jul 2024: Here you can learn about:. The Cambridge Structural Database (CSD). How to use the CSD software and data to inform and advance your research. ... Original deposited data can be obtained and exported for further analysis as well as the values of 3D

  44. FIMs 101 | CCDC

    https://www.ccdc.cam.ac.uk/community/training-and-learning/csdu-modules/fims-101/
    18 Jul 2024: Learn how FIMs are generated using the data in the CSD. Learn how to use FIMs to analyse intermolecular interactions in a structure. ... Wood et al. “Evaluation of molecular crystal structures using Full Interaction Maps”,The Cambridge

  45. Partnerships and Initiatives | CCDC

    https://www.ccdc.cam.ac.uk/community/ccdc-for-the-community/partnerships-and-initiatives/
    18 Jul 2024: To ensure we provide the relevant tools, services and data to advance structural science we partner with data, software, pharmaceutical and chemical companies. ... The Cambridge Crystallographic Data Centre. 12 Union Road. Cambridge. CB2 1EZ.

  46. A Summer of Data Sharing | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/summer-of-data-sharing/
    18 Jul 2024: as the data that you are used to seeing in ConQuest or Mercury. ... Some of the data added this year to our handmade CIFs collection comes from thesis papers where the structures may not have been a main topic of the science discussed so

  47. June 2024 Data Update | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/june-2024-data-update/
    18 Jul 2024: We are pleased to announce the release of the June 2024 data update of the Cambridge Structural Database (CSD). ... To help you get started, here is a breakdown of just some of the exciting new structures to be found in the June 2024 data release.

  48. Mogul 101 | CCDC

    https://www.ccdc.cam.ac.uk/community/training-and-learning/csdu-modules/mogul-101/
    18 Jul 2024: Having completed the Visualization 101 – Visualizing structural chemistry data with Mercury CSDU module. ... The Cambridge Crystallographic Data Centre. 12 Union Road. Cambridge. CB2 1EZ.

  49. Python 3 and the CSD | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/python-3-and-the-csd/
    18 Jul 2024: This Python interface, providing programmatic access to both CSD data and CSD functionality, has democratised the use of the validated, curated information and methods, allowing scientists to build their own tailored ... The Cambridge Crystallographic

  50. CSD Landscape Generator | CCDC

    https://www.ccdc.cam.ac.uk/solutions/software/csd-landscape-generator/
    18 Jul 2024: From empirical data. The generated structures are based on the experimentally confirmed structures in the Cambridge Structural Database (CSD). ... Yes – the output includes standardized CSP meta-data, for direct use in other CSD-Theory applications.

  51. How can I manage my CSD licence? | CCDC

    https://www.ccdc.cam.ac.uk/discover/blog/how-to-manage-csd-licence/
    18 Jul 2024: Learn how the CSD data and software enables drug discovery and development, functional materials design, agrochemical development and more in our collection of case studies here.. ... Tags. The Cambridge Crystallographic Data Centre. 12 Union Road.

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