MolecularDiffusion.modules.models.diffsbdd

DiffSBDD: E(3)-equivariant pocket-conditioned ligand diffusion.

Ported from https://github.com/arneschneuing/DiffSBDD (commit 5d0d38d). See docs/model_integrations/diffsbdd/INTEGRATION_PLAN.md.

Submodules

• MolecularDiffusion.modules.models.diffsbdd.dynamics
• MolecularDiffusion.modules.models.diffsbdd.egnn
• MolecularDiffusion.modules.models.diffsbdd.en_diffusion

Attributes

DDPM_MODES

Package Contents

MolecularDiffusion.modules.models.diffsbdd.DDPM_MODES