5 projects
molmap
MolMap: An Efficient Convolutional Neural Network Based Molecular Deep Learning Tool
immuno-compass
COMPASS: Generalizable AI predicts immunotherapy outcomes across cancers and treatments.
clsar
Activity Cliff-Informed Contrastive Learning for Molecular Property Prediction
aggmap
Jigsaw-like AggMap: A Robust and Explainable Omics Deep Learning Tool
RRD
RRD: A Reactivity-Related bond/atom-wise Descriptors (RRD) package