Pinned Repositories
kinoml
Structure-informed machine learning for kinase modeling
gh-actions
kinoml
Structure-informed machine learning for kinase modeling
molpy
periodic-table
pylisk
A Python library to interact with the Lisk blockchain.
staged-recipes
A place to submit conda recipes before they become fully fledged conda-forge feedstocks
toxsmi
Toxicity prediction models
maxsmi
maxsmi: a guide to SMILES augmentation. Find the optimal SMILES augmentation for accurate molecular prediction.
teachopencadd
TeachOpenCADD: a teaching platform for computer-aided drug design (CADD) using open source packages and data
t-kimber's Repositories
t-kimber/gh-actions
t-kimber/kinoml
Structure-informed machine learning for kinase modeling
t-kimber/molpy
t-kimber/periodic-table
t-kimber/pylisk
A Python library to interact with the Lisk blockchain.
t-kimber/staged-recipes
A place to submit conda recipes before they become fully fledged conda-forge feedstocks
t-kimber/toxsmi
Toxicity prediction models