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How to generate a 3D molecular structure from a SMILES string | CCDC
https://www.ccdc.cam.ac.uk/discover/blog/smiles-to-3d-chemical-structure-csd/8 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. -
Vanadium | CCDC
https://www.ccdc.cam.ac.uk/elements/vanadium/8 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. -
Case: Why is GOLD unable to dock a particular ligand? …
https://www.ccdc.cam.ac.uk/support-and-resources/support/case/?caseid=f7b3d913-57d1-450b-b555-ca034f7a0c0dThe Cambridge Crystallographic Data Centre (CCDC). The CCDC websites use cookies. By continuing to browse the site you are agreeing to our use of cookies. For more details about cookies and how to manage them, see our cookie policy.. Continue. Why -
FAQs - The Cambridge Crystallographic Data…
https://www.ccdc.cam.ac.uk/support-and-resources/support/search?page=7&q=Graphical%20User%20InterfaceDownloads. Installation. Licensing. Product Information. Product Reference. Runtime Error. Software Usage. -
Table of Contents Pharmacophore Constraints in GOLD…
https://www.ccdc.cam.ac.uk/media/Documentation/0710126D-D4BC-438F-92F0-7D5074240033/GOLD-tutorial-PharmacophoreConstraints.pdf17 Jan 2023: Table of Contents Pharmacophore Constraints in GOLD. 2. Case Study. 3. Introduction. 3. Docking with GOLD without constraints. 5. Defining the Binding Site. 6. Selecting Ligand for Docking. 7. Analysing Docking Results. 10. Docking with -
FAQs - The Cambridge Crystallographic Data…
https://www.ccdc.cam.ac.uk/support-and-resources/support/search?page=7&p=3a168035-d9a2-4248-81cc-6b141373e812Downloads. Installation. Licensing. Product Information. Product Reference. Runtime Error. Software Usage. -
Case: How should I reference enCIFer? - The…
https://www.ccdc.cam.ac.uk/support-and-resources/support/case/?caseid=308f3bcb-bff4-480a-a62f-f8a80282a5caThe Cambridge Crystallographic Data Centre (CCDC). The CCDC websites use cookies. By continuing to browse the site you are agreeing to our use of cookies. For more details about cookies and how to manage them, see our cookie policy.. Continue. How -
Case: Running an API script in Mercury or Hermes fails with the error …
https://www.ccdc.cam.ac.uk/support-and-resources/support/case/?caseid=8b103542-573f-e911-b5d1-005056977c87The Cambridge Crystallographic Data Centre (CCDC). The CCDC websites use cookies. By continuing to browse the site you are agreeing to our use of cookies. For more details about cookies and how to manage them, see our cookie policy.. Continue. -
FAQs - The Cambridge Crystallographic Data…
https://www.ccdc.cam.ac.uk/support-and-resources/support/search?page=15&q=Crystal%20StructureDownloads. Installation. Licensing. Product Information. Product Reference. Runtime Error. Software Usage. -
Case: Which scoring function is best for general use? …
https://www.ccdc.cam.ac.uk/support-and-resources/support/case/?caseid=2b93db74-3672-42fd-b000-bbf4214826f4The Cambridge Crystallographic Data Centre (CCDC). The CCDC websites use cookies. By continuing to browse the site you are agreeing to our use of cookies. For more details about cookies and how to manage them, see our cookie policy.. Continue.
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