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1 - 9 of 9 search results for download |u:downloads.ccdc.cam.ac.uk

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  2. The CSD Python API — CSD Python API 3.1.0 documentation

    https://downloads.ccdc.cam.ac.uk/documentation/API/
    28 Mar 2024: Navigation. ». The CSD Python APINext topic. Quick search. Navigation. ». Copyright 2024, Cambridge Crystallographic Data Centre.

  3. Cookbook documentation — CSD Python API 3.1.0 documentation

    https://downloads.ccdc.cam.ac.uk/documentation/API/cookbook_doc_index.html
    28 Mar 2024: Navigation. ». Cookbook documentationPrevious topic. Quick search. Navigation. ». Copyright 2024, Cambridge Crystallographic Data Centre.

  4. Installation notes — CSD Python API 3.1.0 documentation

    https://downloads.ccdc.cam.ac.uk/documentation/API/installation_notes.html
    28 Mar 2024: If you do not already have a supported Python 3 installation (for example, Python 3.9) then please download and run the latest Windows installer from www.python.org/downloads. ... They are available from the CSD Software Portfolio download page:. CSD

  5. Text-numeric searching — CSD Python API 3.1.0 documentation

    https://downloads.ccdc.cam.ac.uk/documentation/API/descriptive_docs/text_numeric_searching.html
    28 Mar 2024: Navigation. ». Descriptive documentation ». Text-numeric searching. Introduction. The CSD supports a searching of the textual and numerical data associated with the individual entries. Before beginning, we must import the necessary module. >>>

  6. Protein Examples — CSD Python API 3.1.0 documentation

    https://downloads.ccdc.cam.ac.uk/documentation/API/cookbook_examples/protein_examples.html
    28 Mar 2024: local/mirror/pub/pdb/data/structures/all/pdb/pdb{}s.ent.gz', default=None ) group.add_argument( '--pdb_url', nargs='?', help='PDB URL file template', ... raises: requests.HTTPError if an error occurs trying to download the structure. """ #

  7. Docking and scoring — CSD Python API 3.1.0 documentation

    https://downloads.ccdc.cam.ac.uk/documentation/API/descriptive_docs/docking.html
    28 Mar 2024: Navigation. ». Descriptive documentation ». Docking and scoring. Note. The ccdc.docking module is available only to licensed CSD-Discovery, GOLD and CSD-Enterprise users. Introduction. Molecular docking is a widely-used computational tool for

  8. Cavity examples — CSD Python API 3.1.0 documentation

    https://downloads.ccdc.cam.ac.uk/documentation/API/cookbook_examples/cavity_examples.html
    28 Mar 2024: This example shows how to download a PDB file from the wwPDB for a cavity and extract header information using Biopython. ... pdb_req = requests.get('https://files.rcsb.org/download/%s.pdb' % pdb_id) # Raise a requests.HTTPError if any HTTP errors have

  9. Release notes — CSD Python API 3.1.0 documentation

    https://downloads.ccdc.cam.ac.uk/documentation/API/release_notes.html
    28 Mar 2024: For further citation advice, refer to your download agreement and visit.

  10. ccdc.interaction — CSD Python API 3.1.0 documentation

    https://downloads.ccdc.cam.ac.uk/documentation/API/_modules/ccdc/interaction.html
    28 Mar 2024: Please download and install it if you want to use the IsoStar API' ) return os.path.join( central_loc, self._group.que_db() self._group.que_index() '.ini' ) def ... Please download and install it if you want to use the IsoStar API' ) fname =

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