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@NRGlab

Najmanovich Research Group

Computational Systems and structural Pharmacology at the Department of Pharmacology & Physiology, Faculty of Medicine, Université de Montréal

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  1. FlexAID FlexAID Public

    Flexible Artificial Intelligence Docking

    C 17 12

  2. Surfaces Surfaces Public

    Python 14 4

  3. ENCoM ENCoM Public

    Forked from vince1589/encom

    Elastic Network Contact Model (coarse-grained Normal Mode Analysis software)

    C 13 6

  4. IsoMif IsoMif Public

    Forked from mtthchrtr/IsoMif

    IsoMif Development

    C++ 8 4

  5. Get_Cleft Get_Cleft Public

    Forked from lmorency/Get_Cleft

    The Get_Cleft program detects cavities in PDB-formated macromolecular structure models. It is based on the Surfnet algorithm of Laskowski et al.

    C 5 3

  6. NRGsuite NRGsuite Public

    Forked from lmorency/NRGsuite

    NRGsuite is a PyMOL plugin (GUI) for FlexAID

    Python 4 3

Repositories

Showing 10 of 14 repositories
  • NRGSuite-Qt Public
    Python 2 0 0 0 Updated Apr 3, 2025
  • Surfaces Public
    Python 14 4 0 1 Updated Feb 25, 2025
  • Vcontacts Public

    The method calculates the planes of contact the center atom makes will each atom in the contact list, then determines the points of intersection of the planes and intersections with a sphere.

    C 2 1 0 0 Updated Feb 19, 2025
  • NRGRank Public
    Python 2 GPL-3.0 0 0 0 Updated Feb 19, 2025
  • MOR_DynaSig-ML Public

    A Jupyter notebook allowing readers of the Galdino et al. (2024) article to train their own predictive ENCoM ES models with DynaSig-ML.

    Jupyter Notebook 0 GPL-3.0 0 0 0 Updated Jan 17, 2024
  • nrglab.github.io Public
    HTML 0 0 0 0 Updated Jul 15, 2023
  • NRGsuite Public Forked from lmorency/NRGsuite

    NRGsuite is a PyMOL plugin (GUI) for FlexAID

    Python 4 7 0 0 Updated Jul 7, 2023
  • FlexAID Public

    Flexible Artificial Intelligence Docking

    C 17 Apache-2.0 12 0 1 Updated Aug 23, 2021
  • HTS_LargeScaleDocking Public Forked from padideee/High-Throughput-Simulation
    Perl 0 2 0 0 Updated Feb 15, 2021
  • GetPDBseq Public

    GetPDBSeq.pl is a Perl script to extract sequence information from a PDB file

    Perl 2 1 0 0 Updated Jan 30, 2020
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