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.
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.
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
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
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
T.O. Sharpee; J.D. Victor 2009 Contextual modulation of V1 receptive fields depends on their spatial symmetry.
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
J.D. Durrant; R.E. Amaro; J.A. McCammon 2009 AutoGrow: A Novel Algorithm for Protein Inhibitor Design. Chem. Biol. Drug Design