Enhancing De Novo Drug Design with QADD: A Powerful Combination of Reinforcement Learning and Graph-based Molecular Quality Assessment
Scientists from Shanghai have developed a de novo drug design method, QADD (quality assessment-based drug design approach). The multi-objective reinforcement learning-based method is capable of designing chemical molecules with desired properties using a novel Quality Assessment (QA) module. The novel drug design framework is able to cover a large territory of the chemical space that was previously…


















































