| Enabling light work in helical self-assembly for dynamic amplification of chirality with photoreversibility Y Cai, Z Guo, J Chen, W Li, L Zhong, Y Gao, L Jiang, L Chi, H Tian, ... Journal of the American Chemical Society 138 (7), 2219-2224, 2016 | 156 | 2016 |
| CHARMM-GUI supports hydrogen mass repartitioning and different protonation states of phosphates in lipopolysaccharides Y Gao, J Lee, IPS Smith, H Lee, S Kim, Y Qi, JB Klauda, G Widmalm, ... Journal of chemical information and modeling 61 (2), 831-839, 2021 | 100 | 2021 |
| Polarization of intraprotein hydrogen bond is critical to thermal stability of short helix Y Gao, X Lu, LL Duan, JZH Zhang, Y Mei The Journal of Physical Chemistry B 116 (1), 549-554, 2012 | 48 | 2012 |
| Ferrocene‐grafted photochromic triads based on a sterically hindered ethene bridge: Redox‐switchable fluorescence and gated photochromism Y Cai, Y Gao, Q Luo, M Li, J Zhang, H Tian, WH Zhu Advanced Optical Materials 4 (9), 1410-1416, 2016 | 41 | 2016 |
| Exploring drug-resistant mechanisms of I84V mutation in HIV-1 protease toward different inhibitors by thermodynamics integration and solvated interaction energy method Y Gao, T Zhu, J Chen Chemical Physics Letters 706, 400-408, 2018 | 36 | 2018 |
| Invisible photochromism and optical anti-counterfeiting based on D–A type inverse diarylethene J Wang, Y Gao, J Zhang, H Tian Journal of Materials Chemistry C 5 (18), 4571-4577, 2017 | 32 | 2017 |
| Modeling and simulation of bacterial outer membranes with lipopolysaccharides and enterobacterial common antigen Y Gao, J Lee, G Widmalm, W Im The Journal of Physical Chemistry B 124 (28), 5948-5956, 2020 | 30 | 2020 |
| Treatment of hydrogen bonds in protein simulations Y Gao, Y Mei, JZH Zhang Advanced materials for renewable hydrogen production, storage and …, 2015 | 30 | 2015 |
| A test of AMBER force fields in predicting the secondary structure of α-helical and β-hairpin peptides Y Gao, C Zhang, X Wang, T Zhu Chemical Physics Letters 679, 112-118, 2017 | 28 | 2017 |
| Folding of a helix is critically stabilized by polarization of backbone hydrogen bonds: Study in explicit water LL Duan, Y Gao, Y Mei, QG Zhang, B Tang, JZH Zhang The Journal of Physical Chemistry B 116 (10), 3430-3435, 2012 | 26 | 2012 |
| Naphthalimide end-capping molecular rotors with different donor cores: Tuning emission in wide gamut and cell imaging Y Zhang, Y Qu, J Wu, Y Rui, Y Gao, Y Wu Dyes and Pigments 179, 108431, 2020 | 21 | 2020 |
| A quantum mechanical computational method for modeling electrostatic and solvation effects of protein X Wang, Y Li, Y Gao, Z Yang, C Lu, T Zhu Scientific Reports 8 (1), 5475, 2018 | 19 | 2018 |
| Supramolecular organisation and dynamics of mannosylated phosphatidylinositol lipids in the mycobacterial plasma membrane CM Brown, RA Corey, Y Gao, YK Choi, M Gilleron, N Destainville, ... Biophysical Journal 122 (3), 136a, 2023 | 17 | 2023 |
| Benchmark force fields for the molecular dynamic simulation of G-quadruplexes N Li, Y Gao, F Qiu, T Zhu Molecules 26 (17), 5379, 2021 | 17 | 2021 |
| Correct folding of an α-helix and a β-hairpin using a polarized 2D torsional potential Y Gao, Y Li, L Mou, B Lin, JZH Zhang, Y Mei Scientific reports 5 (1), 10359, 2015 | 17 | 2015 |
| A method for efficient calculation of thermal stability of proteins upon point mutations B Wang, Y Qi, Y Gao, JZH Zhang Physical Chemistry Chemical Physics 22 (16), 8461-8466, 2020 | 14 | 2020 |
| Direct folding simulation of a long helix in explicit water Y Gao, X Lu, L Duan, D Zhang, Y Mei, JZH Zhang Applied Physics Letters 102 (19), 2013 | 13 | 2013 |
| Influences of Vibrio cholerae Lipid A Types on LPS Bilayer Properties E Luna, S Kim, Y Gao, G Widmalm, W Im The Journal of Physical Chemistry B 125 (8), 2105-2112, 2021 | 12 | 2021 |
| A coupled two-dimensional main chain torsional potential for protein dynamics: generation and implementation Y Li, Y Gao, X Zhang, X Wang, L Mou, LL Duan, X He, Y Mei, JZH Zhang Journal of molecular modeling 19, 3647-3657, 2013 | 12 | 2013 |
| Folding simulation of Trp-cage utilizing a new AMBER compatible force field with coupled main chain torsions L Mou, X Jia, Y Gao, Y Li, JZH Zhang, Y Mei Journal of Theoretical and Computational Chemistry 13 (04), 1450026, 2014 | 10 | 2014 |
John Z.H. ZhangProfessor of Chemistry, NYU Shanghai, ECNU, SUATبريد إلكتروني تم التحقق منه على nyu.edu
