Skip to content
@URV-cheminformatics

URV-cheminformatics

Popular repositories Loading

  1. DecoyFinder DecoyFinder Public

    A tool that helps finding decoy molecules for a given target, provided a set of active molecules.

    Python 12 13

  2. VHELIBS VHELIBS Public

    Validation HElper for LIgands and Binding Sites

    Python 6 1

  3. PDB-CAT PDB-CAT Public

    PDB-CAT aims to automatically categorize the mmCIF PDB structures based on the type of interaction between atoms in the protein and the ligand, and checking for any mutations in the sequence.

    Python 6

  4. Evaluation-of-conformer-generation-tools Evaluation-of-conformer-generation-tools Public

    Repository containing scripts and data for the evaluation of conformer generation tools.

    Python 3

Repositories

Showing 4 of 4 repositories
  • PDB-CAT Public

    PDB-CAT aims to automatically categorize the mmCIF PDB structures based on the type of interaction between atoms in the protein and the ligand, and checking for any mutations in the sequence.

    URV-cheminformatics/PDB-CAT’s past year of commit activity
    Python 6 AGPL-3.0 0 0 0 Updated Nov 4, 2024
  • VHELIBS Public

    Validation HElper for LIgands and Binding Sites

    URV-cheminformatics/VHELIBS’s past year of commit activity
    Python 6 AGPL-3.0 1 0 0 Updated Feb 8, 2024
  • DecoyFinder Public

    A tool that helps finding decoy molecules for a given target, provided a set of active molecules.

    URV-cheminformatics/DecoyFinder’s past year of commit activity
    Python 12 AGPL-3.0 13 2 0 Updated Feb 24, 2022
  • Evaluation-of-conformer-generation-tools Public

    Repository containing scripts and data for the evaluation of conformer generation tools.

    URV-cheminformatics/Evaluation-of-conformer-generation-tools’s past year of commit activity
    Python 3 0 0 0 Updated Jun 25, 2013

Top languages

Loading…

Most used topics

Loading…