| 451 - 462 |
Computational Assessment of Potassium and Magnesium Ion Binding to a Buried Pocket in GTPase-Associating Center RNA
Hayatshahi HS, Roe DR, Galindo-Murillo R, Hall KB, Cheatham TE |
| 463 - 470 |
Modeling of Transient Absorption Spectra in Exciton-Charge-Transfer Systems
Kramer T, Rodriguez M, Zelinskyy Y |
| 471 - 478 |
Theoretical Insights into the Reaction and Inhibition Mechanism of Metal-Independent Retaining Glycosyltransferase Responsible for Mycothiol Biosynthesis
Capurro JIB, Hopkins CW, Sottile GP, Lebrero MCG, Roitberg AE, Marti MA |
| 479 - 489 |
Infrared Spectroscopy and Born-Oppenheimer Molecular Dynamics Simulation Study on Deuterium Substitution in the Crystalline Benzoic Acid
Glug M, Brela MZ, Boczar M, Turek AM, Boda L, Wojcik MJ, Nakajima T, Ozaki Y |
| 490 - 496 |
Directly Probing Intermolecular Structural Change of a Core Fragment of beta(2)-Microglobulin Amyloid Fibrils with Low-Frequency Raman Spectroscopy
Shigeto S, Chang CF, Hiramatsu H |
| 497 - 507 |
Single- and Double-Strand Breaks of Dry DNA Exposed to Protons at Bragg-Peak Energies
Souici M, Khalil TT, Muller D, Raffy Q, Barillon R, Belafrites A, Champion C, Fromm M |
| 508 - 517 |
Human Neuronal Calcium Sensor-1 Protein Avoids Histidine Residues To Decrease pH Sensitivity
Gong YH, Zhu YZ, Zou Y, Ma BY, Nussinov R, Zhang QW |
| 518 - 528 |
On Atomistic Models for Molecular Oxygen
Javanainen M, Vattulainen I, Monticelli L |
| 529 - 549 |
Microsecond Simulation of Electron Transfer in DNA: Bottom-Up Parametrization of an Efficient Electron Transfer Model Based on Atomistic Details
Wolter M, Elstner M, Kleinekathofer U, Kubar T |
| 550 - 564 |
Mechanism of Unfolding of Human Prion Protein
Singh RK, Chamachi NG, Chakrabarty S, Mukherjee A |
| 565 - 576 |
Electrostatic Interactions Govern "Odd/Even" Effects in Water-Induced Gemini Surfactant Self-Assembly
Mantha S, McDaniel JG, Perroni DV, Mahanthappa MK, Yethiraj A |
| 577 - 588 |
Trends in Two- and Three-Body Effects in Multiscale Clusters of Ionic Liquids
Halat P, Seeger ZL, Acevedo SB, Izgorodina EI |
| 589 - 598 |
Free-Energy-Gap Law for Ultrafast Charge Recombination of Ion Pairs Formed by Intramolecular Photoinduced Electron Transfer
Nazarov AE, Malykhin R, Ivanov AI |
| 599 - 609 |
Interactions in Water-Ionic Liquid Mixtures: Comparing Protic and Aprotic Systems
Reid JESJ, Gammons RJ, Slattery JM, Walker AJ, Shimizu S |
| 610 - 619 |
Nanometer-Sized Water Bridge and Pull-Off Force in AFM at Different Relative Humidities: Reproducibility Measurement and Model Based on Surface Tension Change
Bartosik M, Kormos L, Flajsman L, Kalousek R, Mach J, Liskova Z, Nezval D, Svarc V, Samoril T, Sikola T |
| 620 - 629 |
Mesoscopic Correlation Functions in Heterogeneous Ionic Liquids
Weiss H, Mars J, Li HL, Kircher G, Ivanova O, Feoktystov A, Soltwedel O, Bier M, Mezger M |
| 630 - 637 |
Solvation Dynamics and Proton Transfer in Diethylaminohydroxyflavone
Rumble CA, Breffke J, Maroncelli M |
| 638 - 648 |
Ethylcellulose Colloids Incubated in Dilute Solution
Yi HL, Lai LJ, Jiang JS, Hua CC |
| 649 - 656 |
Statistical Ring Catenation under Thermodynamic Control: Should the Jacobson-Stockmayer Cyclization Theory Take into Account Catenane Formation?
Di Stefano S, Ercolani G |
