2009

S. Wong; R.E. Amaro; J.A. McCammon 2009 MM-PBSA Captures Key Role of Intercalating Water Molecules at a Protein-Protein Interface. J. Chem. Theor. Comp.
B.Z. Lu; X.L. Cheng; J.F. Huang; J.A. McCammon 2009 An Adaptive Fast Multipole Boundary Element Method for Poisson-Boltzmann Electrostatics.
C. Hyeon; P.A. Jennings; J.A. Adams; J.N. Onuchic 2009 Ligand-induced global transitions in the catalytic domain of protein kinase A. Proc. Nat. Acad. Sci. USA
A.A. Gorfe; B.Z. Lu; Z.Y. Yu; J.A. McCammon 2009 Enzymatic Activity versus Structural Dynamics: The Case of Acetylcholinesterase Tetramer. Biophys. J.
A. Agrawal; C.A.F. de Oliveira; Y.H. Cheng; J.A. Jacobsen; J.A. McCammon; S.M. Cohen 2009 Thioamide Hydroxypyrothiones Supersede Amide Hydroxypyrothiones in Potency against Anthrax Lethal Factor.
A. Schug; M. Weigt; J.N. Onuchic; T. Hwa; H. Szurmant 2009 High-resolution protein complexes from integrating genomic information with molecular simulation. Proc. Nat. Acad. Sci. USA
P.G. Wolynes 2009 Some quantum weirdness in physiology. Proc. Nat. Acad. Sci. USA
Y. Gambin; A. Schug; E.A. Lemke; J.J. Lavinder; A.C.M. Ferreon; T.J. Magliery; J.N. Onuchic; A.A.… 2009 Direct single-molecule observation of a protein living in two opposed native structures. Proc. Nat. Acad. Sci. USA
J.A. Hegler; J. Latzer; A. Shehu; C. Clementi; P.G. Wolynes 2009 Restriction versus guidance in protein structure prediction. Proc. Nat. Acad. Sci. USA
T.O. Sharpee; J.D. Victor 2009 Contextual modulation of V1 receptive fields depends on their spatial symmetry.