| 5151 - 5161 |
Deficiencies in Molecular Dynamics Simulation-Based Prediction of Protein-DNA Binding Free Energy Landscapes
Khabiri M, Freddolino PL |
| 5162 - 5173 |
Simulated Force Quench Dynamics Shows GB1 Protein Is Not a Two State Folder
Berkovich R, Mondal J, Paster I, Berne BJ |
| 5174 - 5186 |
Direct Determination of Site-Specific Noncovalent Interaction Strengths of Proteins from NMR-Derived Fast Side Chain Motional Parameters
Rajeshwar TR, Krishnan M |
| 5187 - 5196 |
Solvatochromic Effects on the Absorption Spectrum of 2-Thiocytosine
Mai S, Ashwood B, Marquetand P, Crespo-Hernandez CE, Gonzalez L |
| 5197 - 5208 |
Molecular Simulations of Mixed Lipid Bilayers with Sphingomyelin, Glycerophospholipids, and Cholesterol
Bera I, Klauda JB |
| 5209 - 5217 |
Lipid-Mediated Clusters of Guest Molecules in Model Membranes and Their Dissolving in the Presence of Lipid Rafts
Kardash ME, Dzuba SA |
| 5218 - 5227 |
Protonation Kinetics Compromise Liposomal Fluorescence Assay of Membrane Permeation
Sezer D, Oruc T |
| 5228 - 5237 |
Predicting a Drug's Membrane Permeability: A Computational Model Validated With in Vitro Permeability Assay Data
Bennion BJ, Be NA, McNerney MW, Lao V, Carlson EM, Valdez CA, Malfatti MA, Enright HA, Nguyen TH, Lightstone FC, Carpenter TS |
| 5238 - 5246 |
Mechanism of CO2 Reforming of CH4 on a Pt-4/ZrO2(101) Surface: A Density Functional Theory Study
Wang YX, Gao HW |
| 5247 - 5258 |
New Insights into the Reaction Paths of 4-Carboxybenzophenone Triplet with Oligopeptides Containing N- and C-Terminal Methionine Residues
Filipiak P, Bobrowski K, Hug GL, Pogocki D, Schoneich C, Marciniak B |
| 5259 - 5272 |
Continuous Diffusion Model for Concentration Dependence of Nitroxide EPR Parameters in Normal and Supercooled Water
Merunka D, Peric M |
| 5273 - 5278 |
Dielectric Response of Cytoplasmic Water and Its Connection to the Vitality of Human Red Blood Cells. II. The Influence of Storage
Levy E, David M, Barshtein G, Yedgar S, Livshits L, Ben Ishai P, Feldman Y |
| 5279 - 5292 |
Structural Investigations on Lithium-Doped Protic and Aprotic Ionic Liquids
Ray P, Vogl T, Balducci A, Kirchner B |
| 5293 - 5299 |
Theoretical Study of the Solvation Effect on the Reductive Reaction of Vinylene Carbonate in the Electrolyte Solution of Lithium Ion Batteries
Kasahara K, Nakano H, Sato H |
| 5300 - 5307 |
Mechanism of the Piperidine-Catalyzed Knoevenagel Condensation Reaction in Methanol: The Role of Iminium and Enolate Ions
Dalessandro EV, Collin HP, Guimaraes LGL, Valle MS, Pliego JR |
