Ecosyste.ms: Repos
An open API service providing repository metadata for many open source software ecosystems.
GitHub topics: computational-drug-discovery
Curtis-Wu/Equivariant-Graph-Transformer
A deep neural network with hybrid architecture (EGNN + Transformer) for molecular properties prediction.
Language: Jupyter Notebook - Size: 41.6 MB - Last synced: 6 months ago - Pushed: 6 months ago - Stars: 3 - Forks: 0
francescopatane96/Computer_aided_drug_discovery_kit
This pipeline provides a way to perform pharmaceutical compounds virtual screening using similarity-based analysis, ligand-based and structure-based techniques. The pipeline contains a collections of modules to perform a variety of analysis.
Language: Jupyter Notebook - Size: 4.43 MB - Last synced: 9 months ago - Pushed: 9 months ago - Stars: 4 - Forks: 2
anothermorena/MLProjects
This is a compilation of machine learning projects I have worked on.
Language: Jupyter Notebook - Size: 2.14 MB - Last synced: about 1 year ago - Pushed: over 1 year ago - Stars: 1 - Forks: 0
