Quin Hu

University of Otago — New Zealand

Materials Science · Physical Sciences

4h-index63citations14works1.02yr avg
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Research Topics

Machine Learning in Materials Science(7), Protein Structure and Dynamics(4), RNA and protein synthesis mechanisms(4), Computational Drug Discovery Methods(3), Social and Intergroup Psychology(2)

Publications14 total

Cultural Differences in the Perception of Control and Intergroup Discrimination
Diversity and inclusion research·2025
Training Transferable Interatomic Neural Network Potentials for Reactive Chemistry: Improved Chemical Space Sampling
2024· 2 citedOpen Access
Author response for "Neural network potentials for reactive chemistry: CASPT2 quality potential energy surfaces for bond breaking"
2023
Alkane dataset for reactive chemistry neural network potentials at DFT and CASPT2 level
Zenodo (CERN European Organization for Nuclear Research)·2023Open Access
Alkane dataset for reactive chemistry neural network potentials at DFT and CASPT2 level
2023· 2 citedOpen Access
Neural Network Potentials for Reactive Chemistry: CASPT2 Quality Potential Energy Surfaces for Bond Breaking
2023· 2 citedOpen Access
Neural network potentials for reactive chemistry: CASPT2 quality potential energy surfaces for bond breaking
Digital Discovery·2023· 12 citedOpen Access
Editing Domain Motions Preorganize the Synthetic Active Site of Prolyl-tRNA Synthetase
ACS Catalysis·2020· 7 citedOpen Access
Transfer learning of neural network potentials for reactive chemistry
Bulletin of the American Physical Society·2020
Crowder-Induced Conformational Ensemble Shift in Escherichia coli Prolyl-tRNA Synthetase
Biophysical Journal·2019· 22 citedOpen Access
Crowder-induced Conformational Ensemble Shift in <i>Escherichia Coli</i> Prolyl-tRNA Synthetase
2019Open Access
Cyclic Changes in Active Site Polarization and Dynamics Drive the “Ping-pong” Kinetics in NRH:Quinone Oxidoreductase 2: An Insight from QM/MM Simulations
ACS Catalysis·2018· 12 citedOpen Access
Collective Identity and Intergroup Discrimination: Outcomes in Contexts that Emphasize and do not Emphasize Intergroup Relations
International Journal of Psychology & Behavior Analysis·2015· 4 citedOpen Access
Structure of the Streptococcus pneumoniae leucyl-tRNA synthetase editing domain bound to a benzoxaborole-AMP adduct
2013

Frequent Co-authors

Jason D. Goodpaster(7), Sanchita Hati(4), Lauren Adams(3), Sudeep Bhattacharyya(3), Andrew Johannesen(3), Daniel S. Graham(3), Ryan J. Andrews(2), Heidi L. Schmit(2), Clorice R. Reinhardt(2), Caitlin G. Bresnahan(1), Murphi T. Williams(1), Irina Shulgina(1), Carl Fossum(1), Katelyn Weeks(1), Karin Musier‐Forsyth(1), John A. Hunter(1), Maurice Stringer(1), Mike Banks(1), Sarah Kafka(1), Genevieve Iversen(1)