Mao, Yuezhi

1. SPICE, A Dataset of Drug-like Molecules and Peptides for Training Machine Learning Potentials
   2022/09/21 by Peter Eastman, Pavan Kumar Behara, Eastman, Peter +21 · 46 citations
   Biochemistry, Genetics and Molecular Biology · Materials Science · #Biomolecules (q-bio.BM) #Chemical Physics (physics.chem-ph) #Chemical Synthesis and Analysis #FOS: Biological sciences #FOS: Computer and information sciences #FOS: Physical sciences #Machine Learning (cs.LG) #Machine Learning in Materials Science #Protein Structure and Dynamics
2. Elucidating the role of hydrogen bonding in the optical spectroscopy of the solvated green fluorescent protein chromophore: using machine learning to establish the importance of high-level electronic structure
   2023/05/26 by Michael S. Chen, Yuezhi Mao, Chen, Michael S. +13 · 1 citation
   Biochemistry, Genetics and Molecular Biology · Neuroscience · Physics and Astronomy · #Advanced Fluorescence Microscopy Techniques #Chemical Physics (physics.chem-ph) #Disordered Systems and Neural Networks (cond-mat.dis-nn) #FOS: Physical sciences #Photoreceptor and optogenetics research #Spectroscopy and Quantum Chemical Studies