yangnianzu0515/MoleOOD
Official implementation for the paper "Learning Substructure Invariance for Out-of-Distribution Molecular Representations" (NeurIPS 2022).
PythonMIT
Issues
- 3
High variance of the result on DrugOOD.
#3 opened by panmianzhi - 1
hyper-parameter to reproduce the results
#2 opened by JiahaoChen1