molforge.wrappers

Thin wrappers around external engines. Each subcategory has its own abstract base class and one or more concrete engines; see the wrappers guide for the design rationale.

Subpackage	Engines
molforge.wrappers.folding	ESMFold, AlphaFold, Boltz, RoseTTAFold (Rosetta is a deprecated alias)
molforge.wrappers.docking	Vina, DiffDock + receptor/ligand prep
molforge.wrappers.md	OpenMM, GROMACS (stub)
molforge.wrappers.generative	RFdiffusion, ProteinMPNN