TranGRU: focusing on both the local and global information of molecules for molecular property prediction
Jing Jiang, Ruisheng Zhang, Jun Ma, Yunwu Liu, Enjie Yang, Shikang Du, Zhili Zhao, Yongna Yuan
Topics & Concepts
Computer scienceEncoderENCODEArtificial intelligenceProperty (philosophy)Encoding (memory)Task (project management)F1 scorePattern recognition (psychology)ChemistryGeneManagementOperating systemEpistemologyPhilosophyBiochemistryEconomicsComputational Drug Discovery MethodsMachine Learning in Materials ScienceProtein Structure and Dynamics