Leveraging language model for advanced multiproperty molecular optimization via prompt engineering
Zhenxing Wu, Odin Zhang, Xiaorui Wang, Li Fu, Huifeng Zhao, Jike Wang, Hongyan Du, Dejun Jiang, Yafeng Deng, Dongsheng Cao, Chang‐Yu Hsieh, Tingjun Hou
Topics & Concepts
Computer scienceComputational Drug Discovery MethodsChemical Synthesis and AnalysisMachine Learning in Materials Science