wujialu/MF-SuP-pKa
Pytorch implementation of “MF-SuP-pKa: multi-fidelity modeling with subgraph pooling mechanism for pKa prediction”
Python
Issues
- 6
Question about dataset
#3 opened by WangPenglei717 - 2
Release model for inference
#1 opened by ddomingof - 1
FileNotFoundError
#2 opened by sptiwari