Yi Shang, Ph.D.

Affiliations: 
2013 Molecular and Cellular Biology Stony Brook University, Stony Brook, NY, United States 
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"Yi Shang"
Mean distance: 5687.57
 

Parents

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Carlos Simmerling grad student 2013 SUNY Stony Brook
 (Computer-aided Drug Design Targeting Aspartic Proteases.)
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Publications

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Marino KA, Shang Y, Filizola M. (2017) Insights into the Function of Opioid Receptors from Molecular Dynamics Simulations of Available Crystal Structures. British Journal of Pharmacology
Shang Y, Yeatman HR, Provasi D, et al. (2016) Proposed Mode of Binding and Action of Positive Allosteric Modulators at Opioid Receptors. Acs Chemical Biology
Shang Y, Yeatman HR, Burford N, et al. (2015) Binding Pockets and Poses of Allosteric Modulators of Opioid Receptors Identified by Metadynamics Biophysical Journal. 108: 4-5
Shang Y, LeRouzic V, Schneider S, et al. (2014) Mechanistic insights into the allosteric modulation of opioid receptors by sodium ions. Biochemistry. 53: 5140-9
Shang Y, Le Rouzic V, Pasternak GW, et al. (2014) A Molecular-Level Investigation of the Effect of Sodium Ions on the Binding of Opioid Ligands to their Receptors Biophysical Journal. 106: 105a
Shang Y, Simmerling C. (2012) Molecular dynamics applied in drug discovery: the case of HIV-1 protease. Methods in Molecular Biology (Clifton, N.J.). 819: 527-49
Shang Y, Nguyen H, Wickstrom L, et al. (2011) Improving the description of salt bridge strength and geometry in a Generalized Born model. Journal of Molecular Graphics & Modelling. 29: 676-84
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