/tools/reinforced-genetic-algorithm
reinforced-genetic-algorithm
futianfan/reinforced-genetic-algorithm
summary
This tool implements a reinforced genetic algorithm for structure-based drug design, utilizing neural models to enhance the efficiency of molecular optimization. It aims to intelligently explore chemical space to identify potential drug candidates with improved binding affinity.
description
Structure-based Drug Design; Reinforcement Learning and Genetic Algorithm
topics
drug-designdrug-discoverygenetic-algorithmmolecule-generationreinforcement-learning
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