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@docking-org

Docking.org Team

The UCSF DOCK / ZINC / systems pharmacology development team develops software and databases for ligand discovery.

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  1. ChemInfTools ChemInfTools Public

    A collection of small scripts and utilities that would otherwise float around in other repositories

    Python 15 12

  2. pydock3 pydock3 Public

    Python package wrapping the DOCK Fortran program and providing several tools built on top of it.

    Fortran 14 3

  3. smilite smilite Public

    Forked from rasbt/smilite

    A Python module to retrieve and compare SMILE strings of chemical compounds from the free ZINC online database

    Python 3 1

  4. dude-z-benchmark dude-z-benchmark Public

    Shell 3

  5. zinc22-2d zinc22-2d Public

    2d preprocessing scripts for zinc22

    PLpgSQL 2 2

  6. zinc22-3d zinc22-3d Public

    Repository for scripts relating to the dock3 ligand pipeline- the creation of db2 files. Depends on commercial software (sold separately from their respective vendors)

    Python 2 1

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