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LBQC

Laboratorio de Bioinformática y Química Computacional

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  1. moltiverse moltiverse Public

    Molecular conformer generation using enhanced sampling methods

    Crystal 7

  2. polypharm polypharm Public

    A Python-based library to perform IFD and MM/GBSA calculations on different targets using a polypharmacological approach.

    Python 3

  3. docs docs Public

    Documentation for the LBQC cluster

    CSS

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Showing 3 of 3 repositories
  • moltiverse Public

    Molecular conformer generation using enhanced sampling methods

    ucm-lbqc/moltiverse’s past year of commit activity
    Crystal 7 MIT 0 6 0 Updated Oct 24, 2024
  • polypharm Public

    A Python-based library to perform IFD and MM/GBSA calculations on different targets using a polypharmacological approach.

    ucm-lbqc/polypharm’s past year of commit activity
    Python 3 MIT 0 1 0 Updated May 6, 2024
  • docs Public

    Documentation for the LBQC cluster

    ucm-lbqc/docs’s past year of commit activity
    CSS 0 MIT 0 0 0 Updated Apr 26, 2024

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