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Advanced search and analysis using the CSD Python API ...
https://www.ccdc.cam.ac.uk/media/Advanced-search-with-API.pdf23 Jun 2023: https://visualstudio.microsoft.com/downloads/). PYAPI-002. 4. Activating the command line 1. For this exercise we will be writing the script in a Python file that we can then run -
1 Company Number 2155347 THE COMPANIES ACT 2006 COMPANY ...
https://www.ccdc.cam.ac.uk/media/Articles-of-Association.pdf28 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. -
Travel Directions TrainCambridge station is a ten minute walk ...
https://www.ccdc.cam.ac.uk/media/CCDC_travel_directions_2024.pdf30 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 -
Table of Contents Introduction…
https://www.ccdc.cam.ac.uk/media/CSDC-AccessStructures.pdf9 Jun 2023: PubChem. 11. Conclusion. 12. Example 4. Downloading. 13. Download options from initial results page. ... 8. You now have a CIF file containing both structures saved to your specified downloads location. -
Table of Contents Introduction…
https://www.ccdc.cam.ac.uk/media/CSDC-Deposition.pdf6 Jun 2023: and-resources/downloads/ 10. A CCDC account is required for downloading the example files. ... 4. Click Retrieve Deposited Files; this will allow you to download a zip file. -
Decifer and CSD Editor User Guide
https://www.ccdc.cam.ac.uk/media/decifer.pdf27 Mar 2024: used for thispurpose, or Python 3.9 can be downloaded from https://www.python.org/downloads/ if you do not have it installed already. •. •. •. •. •. •. ... can be downloaded from theCCDC User Registration Portal -
MOG-001 1 Table of Contents Introduction…
https://www.ccdc.cam.ac.uk/media/HG-Mogul-Intro-MOG-001.pdf19 Jun 2023: Materials For this workshop we will use the file 1JR1_ligand.pdb that you can download from this link. -
Introduction to the CSD Python API (PYAPI-001) 2023.1 CSD ...
https://www.ccdc.cam.ac.uk/media/Introduction-to-API.pdf23 Jun 2023: Materials. For this workshop you will need the file example.cif that you can download here. ... https://visualstudio.microsoft.com/downloads/). PYAPI-001. 4. Example 1: Demonstrating Input and Output. Aim. This example will focus on understanding the -
Table of Contents Introduction…
https://www.ccdc.cam.ac.uk/media/Introduction-to-ConQuest.pdf19 Jun 2023: Table of Contents Introduction. 2. Learning Outcomes. 2. Pre-required Skills. 2. Materials. 2. Overview of ConQuest. 3. Introduction to the Draw Window. 4. ConQuest sketching conventions. 4. Example 1. Searching for Similar Molecules. 5. Viewing -
Table of Contents Introduction…
https://www.ccdc.cam.ac.uk/media/Introduction-to-Hermes.pdf13 Jun 2023: Materials For this workshop we will use the files that you can download from here.
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