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  1. DPEB DPEB Public

    Embedding Database for Human Protein Set

    Python 3

  2. eMolFrag2 eMolFrag2 Public

    A toolkit for fragmenting and analyzing molecular structures.

    Python 2

  3. eSynth2 eSynth2 Public

    C++ 1

  4. eFilter eFilter Public

    Python 1

  5. eToxPred eToxPred Public

    Forked from pulimeng/eToxPred

    A simple tool to predict the general toxicity and calculate the synthesize accessibility (SA) score for small molecules.

    Python

  6. open-data-registry open-data-registry Public

    Forked from awslabs/open-data-registry

    A registry of publicly available datasets on AWS

    Python

Repositories

Showing 9 of 9 repositories
  • MVLM-DT Public Forked from aghimi7/MVLM-DTI
    deepdrugai/MVLM-DT's past year of commit activity
    Python 0 Apache-2.0 1 0 0 Updated Aug 24, 2026
  • DLM--DrugLikenessModel Public

    A bioactivity-grounded Self-Normalizing Neural Network for drug-likeness prediction across classical and bRo5 chemical space.

    deepdrugai/DLM--DrugLikenessModel's past year of commit activity
    Python 0 MIT 0 0 0 Updated Jun 1, 2026
  • eSynth2 Public
    deepdrugai/eSynth2's past year of commit activity
    C++ 0 MIT 1 0 0 Updated May 27, 2026
  • eMolFrag2 Public

    A toolkit for fragmenting and analyzing molecular structures.

    deepdrugai/eMolFrag2's past year of commit activity
    Python 2 MIT 0 3 0 Updated May 27, 2026
  • DPEB Public

    Embedding Database for Human Protein Set

    deepdrugai/DPEB's past year of commit activity
    Python 3 MIT 0 0 0 Updated Mar 13, 2026
  • eFilter Public
    deepdrugai/eFilter's past year of commit activity
    Python 0 Apache-2.0 1 0 0 Updated Feb 6, 2026
  • eToxPred Public Forked from pulimeng/eToxPred

    A simple tool to predict the general toxicity and calculate the synthesize accessibility (SA) score for small molecules.

    deepdrugai/eToxPred's past year of commit activity
    Python 0 GPL-3.0 22 0 0 Updated Nov 11, 2025
  • open-data-registry Public Forked from awslabs/open-data-registry

    A registry of publicly available datasets on AWS

    deepdrugai/open-data-registry's past year of commit activity
    Python 0 Apache-2.0 1,248 0 0 Updated Sep 25, 2025
  • DiffDock Public Forked from gcorso/DiffDock

    Implementation of DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking

    deepdrugai/DiffDock's past year of commit activity
    Python 0 MIT 364 0 0 Updated May 2, 2025

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