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Search results for graph cheminformatics
cheminformatics
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graph
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8 search results found
Dgl Lifesci
⭐
558
Python package for graph neural networks in chemistry and biology
Moleculargraph.jl
⭐
177
Graph-based molecule modeling toolkit for cheminformatics
Kgcn
⭐
105
A graph-based deep learning framework for life science
Molecules
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64
chemical graph theory library for JavaScript
Geo Gcn
⭐
35
The official implementation of the SGCN architecture.
Tucan
⭐
20
A molecular identifier and descriptor for all domains of chemistry.
Aqml
⭐
14
Amons-based quantum machine learning for quantum chemistry
Graphdot
⭐
8
Primary repo at https://gitlab.com/yhtang/graphdot
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1-8 of 8 search results
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