schrodinger.application.transforms.ligprep package

LigPrep transforms for ligand preparation workflows.

This package contains transforms for preparing ligands using LigPrep and related utilities like desalting and stereoisomer expansion.

Submodules

• schrodinger.application.transforms.ligprep.cgx module
• schrodinger.application.transforms.ligprep.core module
• schrodinger.application.transforms.ligprep.desalt module
• schrodinger.application.transforms.ligprep.duplicate_filter module
• schrodinger.application.transforms.ligprep.guard module
• schrodinger.application.transforms.ligprep.htreat module
• schrodinger.application.transforms.ligprep.ligprep4 module
• schrodinger.application.transforms.ligprep.neutralizer module
• schrodinger.application.transforms.ligprep.sdstereoexpand module
• schrodinger.application.transforms.ligprep.stereo_filter module
• schrodinger.application.transforms.ligprep.stereoizer module
• schrodinger.application.transforms.ligprep.summary module
• schrodinger.application.transforms.ligprep.tautomerizer module