Albert C. Pan
Albert C. Pan
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Cited by
Cited by
Structure and dynamics of the M3 muscarinic acetylcholine receptor
AC Kruse, J Hu, AC Pan, DH Arlow, DM Rosenbaum, E Rosemond, ...
Nature 482 (7386), 552-556, 2012
The dynamic process of β2-adrenergic receptor activation
R Nygaard, Y Zou, RO Dror, TJ Mildorf, DH Arlow, A Manglik, AC Pan, ...
Cell 152 (3), 532-542, 2013
Pathway and mechanism of drug binding to G-protein-coupled receptors
RO Dror, AC Pan, DH Arlow, DW Borhani, P Maragakis, Y Shan, H Xu, ...
Proceedings of the National Academy of Sciences 108 (32), 13118-13123, 2011
Activation mechanism of the β2-adrenergic receptor
RO Dror, DH Arlow, P Maragakis, TJ Mildorf, AC Pan, H Xu, DW Borhani, ...
Proceedings of the National Academy of Sciences, 2011
Structural basis for modulation of a G-protein-coupled receptor by allosteric drugs
RO Dror, HF Green, C Valant, DW Borhani, JR Valcourt, AC Pan, ...
Nature 503 (7475), 295-299, 2013
Molecular determinants of drug–receptor binding kinetics
AC Pan, DW Borhani, RO Dror, DE Shaw
Drug discovery today 18 (13-14), 667-673, 2013
Finding transition pathways using the string method with swarms of trajectories
AC Pan, D Sezer, B Roux
The Journal of Physical Chemistry B 112 (11), 3432-3440, 2008
Structural basis for the coupling between activation and inactivation gates in K+ channels
LG Cuello, V Jogini, DM Cortes, AC Pan, DG Gagnon, O Dalmas, ...
Nature 466 (7303), 272-275, 2010
Transitions to catalytically inactive conformations in EGFR kinase
Y Shan, A Arkhipov, ET Kim, AC Pan, DE Shaw
Proceedings of the National Academy of Sciences 110 (18), 7270-7275, 2013
Recovery from slow inactivation in K+ channels is controlled by water molecules
J Ostmeyer, S Chakrapani, AC Pan, E Perozo, B Roux
Nature 501 (7465), 121-124, 2013
Building Markov state models along pathways to determine free energies and rates of transitions
AC Pan, B Roux
The Journal of chemical physics 129 (6), 064107, 2008
Dynamics of nucleation in the Ising model
AC Pan, D Chandler
The Journal of Physical Chemistry B 108 (51), 19681-19686, 2004
Atomic-level characterization of protein–protein association
AC Pan, D Jacobson, K Yatsenko, D Sritharan, TM Weinreich, DE Shaw
Proceedings of the National Academy of Sciences 116 (10), 4244-4249, 2019
Lengthscale dependence of dynamic four-point susceptibilities in glass formers
D Chandler, JP Garrahan, RL Jack, L Maibaum, AC Pan
Physical Review E 74 (5), 051501, 2006
Heterogeneity and growing length scales in the dynamics of kinetically constrained lattice gases in two dimensions
AC Pan, JP Garrahan, D Chandler
Physical Review E 72 (4), 041106, 2005
Demonstrating an order-of-magnitude sampling enhancement in molecular dynamics simulations of complex protein systems
AC Pan, TM Weinreich, S Piana, DE Shaw
Journal of chemical theory and computation 12 (3), 1360-1367, 2016
Quantitative characterization of the binding and unbinding of millimolar drug fragments with molecular dynamics simulations
AC Pan, H Xu, T Palpant, DE Shaw
Journal of chemical theory and computation 13 (7), 3372-3377, 2017
Atomic structure of a toxic, oligomeric segment of SOD1 linked to amyotrophic lateral sclerosis (ALS)
S Sangwan, A Zhao, KL Adams, CK Jayson, MR Sawaya, EL Guenther, ...
Proceedings of the National Academy of Sciences 114 (33), 8770-8775, 2017
On the structural basis of modal gating behavior in K+ channels
S Chakrapani, JF Cordero-Morales, V Jogini, AC Pan, DM Cortes, B Roux, ...
Nature structural & molecular biology 18 (1), 67-74, 2010
Molecular basis of ligand dissociation from the adenosine A2A receptor
D Guo, AC Pan, RO Dror, T Mocking, R Liu, LH Heitman, DE Shaw, ...
Molecular pharmacology 89 (5), 485-491, 2016
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