2012

J.M. Ortiz-Sanchez; S.E. Nichols; J. Sayyah; J.H. Brown; A. McCammon; B.J. Grant 2012 Identification of Potential Small Molecule Binding Pockets on Rho Family GTPases. Plos One
C.D. Eichhorn; J. Feng; K.C. Suddala; N.G. Walter; C.L. Brooks; H.M. Al-Hashimi 2012 Unraveling the structural complexity in a single-stranded RNA tail: implications for efficient ligand binding in the prequeuosine riboswitch. Nucl. Acids Res.
S. Lindert; P.M. Kekenes-Huskey; G. Huber; L. Pierce; J.A. McCammon 2012 Dynamics and Calcium Association to the N-Terminal Regulatory Domain of Human Cardiac Troponin C: A Multiscale Computational Study. J. Phys. Chem. B
D.N. Beratan; J.N. Onuchic 2012 Redox redux. Phys. Chem. Chem. Phys.
M. Lawrenz; J. Wereszczynski; J.M. Ortiz-Sanchez; S.E. Nichols; J.A. McCammon 2012 Thermodynamic integration to predict host-guest binding affinities. J. Comp. Aided Molec. Design
J. Sulkowska; E. Rawdon; K. Millett; J. Onuchic; A. Stasiak 2012 Conservation of complex knotting and slipknotting patterns in proteins. Protein Sci.
D. Bucher 2012 Orientational relaxation of water trapped inside C60 fullerenes. Chem. Phys. Lett.
P.G. Wolynes; W.A. Eaton; A.R. Fersht 2012 Chemical physics of protein folding. Proc. Nat. Acad. Sci. USA
J.K. Noel; A. Schug; A. Verma; W. Wenzel; A.E. Garcia; J.N. Onuchic 2012 Mirror Images as Naturally Competing Conformations in Protein Folding. J. Phys. Chem. B
Z.M. Wang; J.W. Che; L.T. Cheng; J. Dzubiella; B. Li; J.A. McCammon 2012 Level-Set Variational Implicit-Solvent Modeling of Biomolecules with the Coulomb-Field Approximation. J Chem Theory Comput