Data splitting
Add link to data splitting
There several options for dataset splitting, including every splitting implemented in DGL-LifeSci:
Consecutive
Random
Molecular Weight
Scaffold
Stratified
but also:
Custom
Butina Clustering
Add link to data splitting
There several options for dataset splitting, including every splitting implemented in DGL-LifeSci:
Consecutive
Random
Molecular Weight
Scaffold
Stratified
but also:
Custom
Butina Clustering