Pinned Repositories
ML-ensemble-docking
Improving Structure-Based Virtual Screening with Ensemble Docking and Machine Learning
mmpdb
A package to identify matched molecular pairs and use them to predict property changes.
wai261
JosephPParker's Repositories
JosephPParker/wai261
JosephPParker/ML-ensemble-docking
Improving Structure-Based Virtual Screening with Ensemble Docking and Machine Learning
JosephPParker/mmpdb
A package to identify matched molecular pairs and use them to predict property changes.