/tools/MUBDsyn

MUBDsyn

taoshen99/MUBDsyn

9 stars1 forksPythonAdded February 4, 2026
summary

MUBDsyn is a computational tool designed to create synthetic Maximal Unbiased Benchmarking Datasets for virtual screening. It utilizes deep reinforcement learning to generate virtual molecules, enhancing the process of molecular design and evaluation.

description

The official repository for the CBM paper "Deep Reinforcement Learning Enables Better Bias Control in Benchmark for Virtual Screening".

topics

benchmark-datasetsmachine-learningsynthetic-datavirtual-screeninggenerative-modelreinforcement-learning

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