/tools/PMDM

PMDM

Layne-Huang/PMDM

147 stars30 forksPythonAdded February 5, 2026
summary

PMDM is a software tool that enables the generation of 3D bioactive molecules and lead optimization by utilizing a dual diffusion model. It supports molecular docking and provides benchmarks for evaluating generated molecules, making it a valuable resource for drug discovery and molecular design.

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