Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19 A Acharya, R Agarwal, MB Baker, J Baudry, D Bhowmik, S Boehm, ... Journal of Chemical Information and Modeling 60 (12), 5832-5852, 2020 | 177 | 2020 |
Ammonia-Salt Solvent Promotes Cellulosic Biomass Deconstruction Under Ambient Pretreatment Conditions to Enable Rapid Soluble Sugar Production at Ultra-Low Enzyme Loadings SPS Chundawat, L da Costa Sousa, S Roy, Z Yang, S Gupta, R Pal, ... Green Chemistry 22 (1), 204-218, 2019 | 41 | 2019 |
Synthesis of {111}-Faceted Au Nanocrystals Mediated by Polyvinylpyrrolidone: Insights from Density-Functional Theory and Molecular Dynamics SH Liu, WA Saidi, Y Zhou, KA Fichthorn The Journal of Physical Chemistry C 119 (21), 11982-11990, 2015 | 41 | 2015 |
Deconstruction of Biomass Enabled by Local Demixing of Cosolvents at Cellulose and Lignin Surfaces SV Pingali, MD Smith, SH Liu, TB Rawal, Y Pu, R Shah, BR Evans, ... Proceedings of the National Academy of Sciences of the United States of …, 2020 | 40 | 2020 |
Interaction of Zinc Oxide Nanoparticles with Water: Implications for Catalytic Activity TB Rawal, A Ozcan, SH Liu, SV Pingali, O Akbilgic, L Tetard, H O'Neill, ... ACS Applied Nano Materials 2 (7), 4257-4266, 2019 | 40 | 2019 |
Self-Assembled Monolayer Structures of Hexadecylamine on Cu Surfaces: Density-Functional Theory SH Liu, T Balankura, KA Fichthorn Physical Chemistry Chemical Physics 18 (48), 32753-32761, 2016 | 38 | 2016 |
Interaction of Alkylamines with Cu Surfaces: A Metal-Organic Many-Body Force Field SH Liu, KA Fichthorn The Journal of Physical Chemistry C 121 (40), 22531-22541, 2017 | 27 | 2017 |
Synthesis of CuInSe2 Films via Selenizing the Cu-In Alloy-Containing Nanopowders SH Liu, FS Chen, CH Lu Journal of Alloys and Compounds 517, 14-19, 2011 | 18 | 2011 |
Novel Small Molecule Fibroblast Growth Factor 23 Inhibitors Increase Serum Phosphate and Improve Skeletal Abnormalities in Hyp Mice Z Xiao, J Liu, SH Liu, L Petridis, C Cai, L Cao, G Wang, AL Chin, ... Molecular Pharmacology 101 (6), 408-421, 2022 | 12* | 2022 |
Preparation of Thin CuInSe2 Films Using Cu-In Alloy Nanoparticles SH Liu, FS Chen, CH Lu Chemistry Letters 39 (12), 1333-1335, 2010 | 12 | 2010 |
Identification of Small-Molecule Inhibitors of Fibroblast Growth Factor 23 Signaling via In Silico Hot Spot Prediction and Molecular Docking to α-Klotho SH Liu, Z Xiao, SK Mishra, JC Mitchell, JC Smith, LD Quarles, L Petridis Journal of Chemical Information and Modeling 62 (15), 3627-3637, 2022 | 11 | 2022 |
Antimicrobial Zn-Based "TSOL" for Citrus Greening Management: Insights from Spectroscopy and Molecular Simulation SH Liu, TB Rawal, M Soliman, B Lee, T Maxwell, P Rajasekaran, ... Journal of Agricultural and Food Chemistry 67 (25), 6970-6977, 2019 | 8 | 2019 |
Molecular-Level Design of Alternative Media for Energy-Saving Pilot-Scale Fibrillation of Nanocellulose SH Liu, SJ Rukmani, M Mohan, Y Yu, D Vural, DA Johnson, ... Proceedings of the National Academy of Sciences of the United States of …, 2024 | 1 | 2024 |
Structural Asymmetry in FGF23 Signaling SH Liu, Z Xiao, JC Smith, LD Quarles Trends in Pharmacological Sciences 44 (12), 862-864, 2023 | | 2023 |
Innovative High-Feed Rate Additive Manufacturing Using Sustainable Nano/Microcellulose-Reinforced Thermoplastic Composites: Phase II 2021 Q4 J Anderson, K Armstrong, D Chowdhury, K Copenhaver, W Gramlich, ... Oak Ridge National Laboratory Report, 2021 | | 2021 |
Innovative High-Feed Rate Additive Manufacturing Using Sustainable Nano/Microcellulose-Reinforced Thermoplastic Composites: Phase II 2021 Q3 J Anderson, D Chowdhury, K Copenhaver, Y Han, D Johnson, SH Liu, ... Oak Ridge National Laboratory Report, 2021 | | 2021 |
Innovative High-Feed Rate Additive Manufacturing Using Sustainable Nano/Microcellulose-Reinforced Thermoplastic Composites: Phase II 2021 Q2 J Anderson, D Chowdhury, K Copenhaver, Y Han, D Johnson, P Kim, ... Oak Ridge National Laboratory Report, 2021 | | 2021 |
Innovative High-Feed Rate Additive Manufacturing Using Sustainable Nano/Microcellulose-Reinforced Thermoplastic Composites: Phase II 2021 Q1 J Anderson, K Copenhaver, Y Han, D Johnson, J Kerr, P Kim, M Lamm, ... Oak Ridge National Laboratory Report, 2021 | | 2021 |
Shape-Selective Syntheses of Gold and Copper Nanostructures: Insights from Density-Functional Theory and Molecular Dynamics SH Liu The Pennsylvania State University, 2017 | | 2017 |
Preparation and Characterization of Copper Indium Diselenide Thin Films SH Liu National Taiwan University, 2010 | | 2010 |