个人简历

Education\r
B.S. in Chemistry, Sichuan University, Chengdu, China, June 1993\r
M.S. in Chemistry, Institute of Chemistry, Chinese Academy of Sciences, Beijing, China, June 1996. Advisor: Dr. Dalin Yang\r
Ph.D in Chemistry, California Institute of Technology, Pasadena, California, June 2001. \r
Advisor: Professor Rudolph A. Marcus\r
Postdoctoral Research Fellow, California Institute of Technology, 2001- 2002 . \r
Advisor: Professor Rudolph A. Marcus\r
Postdoctoral Research Fellow, Harvard University , December, 2002- 2004. \r
Advisor: Professor Martin Karplus\r
2004年12月至今德州农工大学化学系助理教授

研究领域

"""""物理化学

近期论文

On the enhanced sampling over energy barriers in molecular dynamics simulations, Y.Q. Gao and L. Yang, J. Chem. Phys. 125, 114103 (2006).\r
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A kinetic model for myosin V, Y.D. Wu, Y.Q. Gao, and M. Karplus, Biochemistry, 46, 6318-6330 (2007).\r
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An approximate method for the MD simulations of protein conformational changes, L. Yang and Y. Q. Gao, J. Phys. Chem. B 111, 2969-2975 (2007).\r
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Application of the accelerated MD simulations to the folding of a small protein, L. Yang, M. P. Grubb, and Y. Q. Gao, J. Chem. Phys. 126, 125102 (2007).\r
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A DFT study on the mechanism of phosphodiester cleavage mediated by monozinc complexes, Y. Fan and Y.Q. Gao, J. Am. Chem. Soc. 129, 895-904 (2007).\r
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The effects of hydrophobic and dipole-dipole interactions on the conformational transitions between different model polypeptide structures, Y. Mu and Y. Q. Gao, J. Chem. Phys. 127, 105102 (2007).\r
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Asymmetry in kinesin walking, Q. Shao and Y.Q. Gao, Biochemistry, 46, 9098-9106 (2007).\r
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Selective sampling of transition paths, X. Fu, L, Yang, and Y.Q. Gao, J. Chem. Phys. 127, 154106 (2007).\r
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An approximate theory for the ozone isotopic effect, Y.Q. Gao and R.A. Marcus, J. Chem. Phys. 127, 244316 (2007).\r
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A molecular dynamics simulation study of ammonia transport in CPS, Y. Fan, L. Lund, L. J. Yang, F. Raushel, and Y.Q. Gao, Biochemistry, 47, 2935-2944 (2008).\r
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An integrate-over-temperature approach for the enhanced sampling in molecular dynamics simulations, Y.Q. Gao, J. Chem. Phys. 128, 064105 (2008).\r
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Self-adaptive enhanced sampling in the energy and trajectory spaces: Accelerated thermodynamics and kinetic calculations, Y.Q. Gao, J. Chem. Phys. 128, 134111 (2008).\r
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Enhanced sampling methods for thermodynamics and kinetics simulations, Y.Q. Gao, L.J. Yang, Y. Fan, and Q. Shao, International Review in Physical Chemistry, 27, 201-227 (2008).\r
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Chemomechanical coupling of kinesin and dynein, in Proteins: Energy, Heat and Signal Flow, Taylor & Francis Group (2009).\r
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Thermodynamics and folding pathways of trpzip2, L.J.Yang, Q. Shao, and Y. Q. Gao, J. Phys. Chem. B, 113, 803-808 (2009).\r
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Comparison between integrated and parallel tempering methods in enhanced sampling, L.J. Yang, and Y. Q. Gao, J. Chem. Phys. 130, 124111 (2009).\r
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Free energies and forces in helix–coil transition of homopolypeptides under stretching. F. C. Zegarra, G. N. Peralta, A. M. Coronado and Y. Q. Gao, Phys. Chem. Chem. Phys. 11, 4019-4024 (2009).\r
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A test of implicit solvent models on the folding simulation of the GB1 peptide. Q. Shao, L. Yang, and Y. Q. Gao J. Chem. Phys. 130, 195104 (2009).\r
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A combined computational and experimental studies of the ammonia transport in CPS, Y. Fan, L. Lund, Y.Q. Gao, and F. Raushel, J. Am. Chem, Soc. 131, 10211-10219 (2009).\r
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On the Structure Elucidation using IMS and Molecular Dynamics, F. A. Fernandez-Lima, H. Wei, Y. Q. Gao, D. H. Russell, J. Phys. Chem. A 29, 8221-8234 (2009).\r
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A simple model and assignment of the SFG spectrum for the water/air interface, Y. Fan, X. Chen. P. Cremer, and Y.Q. Gao, J. Phys. Chem. B, 113 11672-11679 (2009).