/tools/DeepFMPO

DeepFMPO

stan-his/DeepFMPO

71 stars28 forksPythonAdded February 8, 2026
summary

DeepFMPO is a tool designed for optimizing drug design through deep reinforcement learning. It allows users to generate and modify molecules based on lead compounds, facilitating the exploration of new drug candidates.

description

Code accompanying the paper "Deep reinforcement learning for multiparameter optimization in de novo drug design"

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