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docking.ai

FOSS Protein Ligand Docking using ML and CSCW

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  1. Deep-Docking-NonAutomated Deep-Docking-NonAutomated Public

    Forked from jamesgleave/Deep-Docking-NonAutomated

    Python

  2. T1105v1 T1105v1 Public

    Shell

  3. docking-ai.github.io docking-ai.github.io Public

    docking.ai website

    CSS

  4. gnina gnina Public

    Forked from gnina/gnina

    A deep learning framework for molecular docking

    C++

  5. papers papers Public

    Papers related to ML AI CSCW docking

  6. T1118v1 T1118v1 Public

    T1118v1 target from CASP15

Repositories

Showing 10 of 37 repositories
  • casp16-L1000 Public

    CASP16 L1000

    docking-ai/casp16-L1000’s past year of commit activity
    Python 0 GPL-3.0 0 0 0 Updated May 10, 2024
  • casp16-L4000 Public

    CASP16 L4000

    docking-ai/casp16-L4000’s past year of commit activity
    0 GPL-3.0 0 0 0 Updated May 4, 2024
  • casp16-L3000 Public

    CASP16 L3000

    docking-ai/casp16-L3000’s past year of commit activity
    0 GPL-3.0 0 0 0 Updated May 4, 2024
  • casp16-L2000 Public

    CASP16 L2000

    docking-ai/casp16-L2000’s past year of commit activity
    0 GPL-3.0 0 0 0 Updated May 4, 2024
  • DynamicBind Public Forked from luwei0917/DynamicBind

    repo for DynamicBind: Predicting ligand-specific protein-ligand complex structure with a deep equivariant generative model

    docking-ai/DynamicBind’s past year of commit activity
    Jupyter Notebook 0 MIT 46 0 0 Updated Feb 13, 2024
  • smilesDrawer Public Forked from reymond-group/smilesDrawer

    A small, highly performant JavaScript component for parsing and drawing SMILES strings. Released under the MIT license.

    docking-ai/smilesDrawer’s past year of commit activity
    JavaScript 0 MIT 72 0 0 Updated Jan 4, 2024
  • chatXML Public Forked from Bradybry/chatXML

    A proposal for a structured LLM prompt method.

    docking-ai/chatXML’s past year of commit activity
    0 9 0 0 Updated Apr 30, 2023
  • T1186 Public

    CASP 15 : T1186

    docking-ai/T1186’s past year of commit activity
    Shell 0 GPL-3.0 0 0 0 Updated Jan 10, 2023
  • Moon-NLP Public Forked from rctatman/Moon-NLP

    project to convert natural langauge traditional US moon names to dates

    docking-ai/Moon-NLP’s past year of commit activity
    R 0 Apache-2.0 1 0 0 Updated Nov 22, 2022
  • docking-ai.github.io Public

    docking.ai website

    docking-ai/docking-ai.github.io’s past year of commit activity
    CSS 0 GPL-3.0 0 0 0 Updated Aug 18, 2022
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