awesome-drug-pair-scoring

awesome-drug-pair-scoring

Readings for "A Unified View of Relational Deep Learning for Drug Pair Scoring."

88apache-2.0

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DeepPurpose

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Jupyter Notebook975bsd-3-clause

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heteronet

heteronet

GNN-based gene-selection deep learning model for drug response prediction

Python0

9 months ago

dgidb

Rails frontend to The Genome Institute's drug gene interaction database.

Ruby95mit

2 years ago

NeoDTI

NeoDTI: Neural integration of neighbor information from a heterogeneous network

Python74apache-2.0

4 years ago

bioinformaticscomputational-biologydeep-learning

bert-loves-chemistry

bert-loves-chemistry: a repository of HuggingFace models applied on chemical SMI

Jupyter Notebook410mit

25 days ago

bertchemical-modellingchemical-smiles-data

OpenChem

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OpenChem: Deep Learning toolkit for Computational Chemistry and Drug Design Rese

Python681mit

12 months ago

computational-biologycomputational-chemistrydeep-learning

teachopencadd

teachopencadd

TeachOpenCADD: a teaching platform for computer-aided drug design (CADD) using o

Jupyter Notebook785cc-by-4.0

4 months ago

awesome-drug-pair-scoring

awesome-drug-pair-scoring

Readings for "A Unified View of Relational Deep Learning for Drug Pair Scoring."

88apache-2.0

2 years ago

chemistryddidecagon

DRKG

DRKG

A knowledge graph and a set of tools for drug repurposing

Jupyter Notebook570apache-2.0

3 years ago

dgldgl-kedrug-repurposing

DeepPurpose

DeepPurpose

A Deep Learning Toolkit for DTI, Drug Property, PPI, DDI, Protein Function Predi

Jupyter Notebook975bsd-3-clause

5 months ago

bioinformaticscovid19ddi

heteronet

heteronet

GNN-based gene-selection deep learning model for drug response prediction

Python0

9 months ago

dockstring

A Python package for molecular docking with an extensive, highly-curated dataset

Python146apache-2.0

4 months ago

awesome-small-molecule-ml

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199cc0-1.0

12 months ago

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deepchem

deepchem

Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Sci

Python5324mit

4 months ago

biologydeep-learningdrug-discovery

dgidb

Rails frontend to The Genome Institute's drug gene interaction database.

Ruby95mit

2 years ago

NeoDTI

NeoDTI: Neural integration of neighbor information from a heterogeneous network

Python74apache-2.0

4 years ago

bioinformaticscomputational-biologydeep-learning

bert-loves-chemistry

bert-loves-chemistry: a repository of HuggingFace models applied on chemical SMI

Jupyter Notebook410mit

25 days ago

bertchemical-modellingchemical-smiles-data

OpenChem

OpenChem

OpenChem: Deep Learning toolkit for Computational Chemistry and Drug Design Rese

Python681mit

12 months ago

computational-biologycomputational-chemistrydeep-learning

teachopencadd

teachopencadd

TeachOpenCADD: a teaching platform for computer-aided drug design (CADD) using o

Jupyter Notebook785cc-by-4.0

4 months ago