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Physical Chemistry Chemical Physics : PCCP|December 15, 2025
Mechanistic insights into KRASG12D inhibitor binding revealed by molecular dynamics simulations of multiple crystal structuresDonghwan Kim, Eunho Lee, Sangbae LeeBiochemistry|October 15, 2020
Activation Microswitches in Adenosine Receptor A2A Function as Rheostats in the Cell MembraneNing Ma, Sangbae Lee, Nagarajan VaidehiJournal of Molecular Graphics & Modelling|November 6, 2022
Biased agonists differentially modulate the receptor conformation ensembles in Angiotensin II type 1 receptorAnita K Nivedha, Sangbae Lee, Nagarajan VaidehiPhysical Chemistry Chemical Physics : PCCP|November 6, 2025
Allosteric inhibition of the PCSK9-LDLR interaction: structural insights for small molecule designYong Su Baek, Siwoo Kim, Eunho Lee, et al.Journal of Chemical Theory and Computation|October 7, 2016
Conserved Mechanism of Conformational Stability and Dynamics in G-Protein-Coupled ReceptorsSupriyo Bhattacharya, Romelia Salomon-Ferrer, Sangbae Lee, et al.Structure (London, England : 1993)|February 5, 2019
Dynamic Role of the G Protein in Stabilizing the Active State of the Adenosine A2A ReceptorSangbae Lee, Anita K Nivedha, Christopher G Tate, et al.The Journal of Physical Chemistry. B|March 4, 2014
Dynamic behavior of the active and inactive states of the adenosine A(2A) receptorSangbae Lee, Supriyo Bhattacharya, Reinhard Grisshammer, et al.Journal of the American Chemical Society|May 8, 2010
Sampling long time scale protein motions: OSRW simulation of active site loop conformational free energies in formyl-CoA:oxalate CoA transferaseSangbae Lee, Mengen Chen, Wei Yang, et al.The Journal of Physical Chemistry. B|March 26, 2015
Structural dynamics and thermostabilization of neurotensin receptor 1Sangbae Lee, Supriyo Bhattacharya, Christopher G Tate, et al.Chemical Science|May 30, 2025
Enhancing binding affinity predictions through efficient sampling with a re-engineered BAR method: a test on GPCR targetsMinkyu Kim, Jian Jeong, Donghwan Kim, et al.Pageof 3