1 - 4 |
Editorial for January 2016 for JPC A/B/C McCoy AB, Shea JE, Murphy CJ, Schatz GC |
5 - 17 |
Molecular Aspects of the Interaction of Iminium and Alkanolamine Forms of the Anticancer Alkaloid Chelerythrine with Plasma Protein Bovine Serum Albumin Bhuiya S, Pradhan AB, Haque L, Das S |
18 - 24 |
BDPA-Doped Polystyrene Beads as Polarization Agents for DNP-NMR Zhang YZ, Baker PJ, Casabianca LB |
25 - 32 |
Benchmarking Calculations of Excitonic Couplings between Bacteriochlorophylls Kenny EP, Kassal I |
33 - 41 |
Folding Simulations of an alpha-Helical Hairpin Motif alpha t alpha with Residue-Specific Force Fields Zeng J, Jiang F, Wu YD |
42 - 48 |
Molecular Dynamics Simulations of 5-Hydroxycytosine Damaged DNA Karolak A, van der Vaart A |
49 - 58 |
Internal Conversion and Vibrational Energy Redistribution in Chlorophyll A Shenai PM, Fernandez-Alberti S, Bricker WP, Tretiak S, Zhao Y |
59 - 68 |
Effects of Charged Cholesterol Derivatives on A beta 40 Amyloid Formation Elbassal EA, Liu HY, Morris C, Wojcikiewicz EP, Du DG |
69 - 76 |
Importance of Hydrophilic Hydration and Intramolecular Interactions in the Thermodynamics of Helix-Coil Transition and Helix-Helix Assembly in a Deca-Alanine Peptide Tomar DS, Weber V, Pettitt BM, Asthagiri D |
77 - 88 |
Molecular Architecture of the Blood Brain Barrier Tight Junction Proteins-A Synergistic Computational and In Vitro Approach Irudayanathan FJ, Trasatti JP, Karande P, Nangia S |
89 - 101 |
Theoretical Insights on the Mechanism of the GTP Hydrolysis Catalyzed by the Elongation Factor Tu (EF-Tu) Acosta-Silva C, Bertran J, Branchadell V, Oliva A |
102 - 116 |
Multimodal Broadband Vibrational Sum Frequency Generation (MM-BB-V-SFG) Spectrometer and Microscope Lee CM, Kafle K, Huang SX, Kim SH |
117 - 122 |
Highly Efficient Computation of the Basal k(on) using Direct Simulation of Protein-Protein Association with Flexible Molecular Models Saglam AS, Chong LT |
123 - 130 |
IL-6 Antibody and RGD Peptide Conjugated Poly(amidoamine) Dendrimer for Targeted Drug Delivery of HeLa Cells Mekuria SL, Debele TA, Chou HY, Tsai HC |
131 - 142 |
Comparative Fluorescence Resonance Energy-Transfer Study in Pluronic Triblock Copolymer Micelle and Niosome Composed of Biological Component Cholesterol: An Investigation of Effect of Cholesterol and Sucrose on the FRET Parameters Roy A, Kundu N, Banik D, Sarkar N |
143 - 153 |
Guanidinium Pairing Facilitates Membrane Translocation Allolio C, Baxova K, Vazdar M, Jungwirth P |
154 - 163 |
Effect of alpha-Tocopherol on the Microscopic Dynamics of Dimyristoylphosphatidylcholine Membrane Sharma VK, Mamontov E, Tyagi M, Urban VS |
164 - 172 |
Naphthalene Derivatives Induce Acyl Chain Interdigitation in Dipalmitoylphosphatidylcholine Bilayers Kamal MA, Raghunathan VA |
173 - 183 |
Mechanism of Hydrotropic Action of Hydrotrope Sodium Cumene Sulfonate on the Solubility of Di-t-Butyl-Methane: A Molecular Dynamics Simulation Study Das S, Paul S |
184 - 192 |
Dynamical Properties of N-Isopropylacrylamide Molecule in Water Revealed by H-1 NMR Studies Sasaki S |
193 - 205 |
Probing the Aggregation Behavior of Neat Imidazolium-Based Alkyl Sulfate (Alkyl = Ethyl, Butyl, Hexyl, and Octyl) Ionic Liquids through Time Resolved Florescence Anisotropy and NMR and Fluorescence Correlation Spectroscopy Study Majhi D, Pabbathi A, Sarkar M |
206 - 216 |
Inner-Shell Water Rearrangement Following Photoexcitation of Tris(2,2'-bipyridine)iron(II) Das AK, Solomon RV, Hofmann F, Meuwly M |
217 - 221 |
Divide-and-Conquer-Type Density-Functional Tight-Binding Molecular Dynamics Simulations of Proton Diffusion in a Bulk Water System Nakai H, Sakti AW, Nishimura Y |
222 - 230 |
Branched Crystalline Patterns of Poly(epsilon-caprolactone) and Poly(4-hydroxystyrene) Blends Thin Films Hou CY, Yang TB, Sun XL, Ren ZJ, Li HH, Yan SK |
231 - 243 |
Conformational and Dynamic Properties of Poly(ethylene oxide) in an Ionic Liquid: Development and Implementation of a First-Principles Force Field McDaniel JG, Choi E, Son CY, Schmidt JR, Yethiraj A |
244 - 249 |
Method for Determining the Activation Energy Distribution Function of Complex Reactions by Sieving and Thermogravimetric Measurements Bufalo G, Ambrosone L |
250 - 258 |
Self-Assembly and Formation of Chromonic Liquid Crystals from the Dyes Quinaldine Red Acetate and Pyronin Y Magana JR, Homs M, Solans C, Obiols-Rabasa M, Salonen LM, Rodriguez-Abreu C |