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Thermal Behavior of H-Aggregate in a Mixed Langmuir−Blodgett Film of Merocyanine Dye, Arachidic Acid, and n-octadecane Ternary System Investigated by UV−visible and IR Absorption Spectroscopy
Adsorption of Ascorbic Acid on the C60 Fullerene
Spatial Desynchronization of Glycolytic Waves as Revealed by Karhunen−Loève Analysis
Hydrogen Storage in sH Hydrates: A Monte Carlo Study
Influence of Hydration on Protein Dynamics: Combining Dielectric and Neutron Scattering Spectroscopy Data
Particle Dispersibility and Giant Reduction in Dynamic Modulus of Magnetic Gels Containing Barium Ferrite and Iron Oxide Particles
Electronic Properties of Metal-Modified DNA Base Pairs
Not Innocent: Verdict from Ab Initio Multiconfigurational Second-Order Perturbation Theory on the Electronic Structure of Chloroiron Corrole
Magnetic Field Effect on a Radical Pair Reaction as a Probe of Microviscosity
The Nature of the Charge Carriers in Polyazulene as Studied by in Situ Electron Spin Resonance−UV−Visible−Near-Infrared Spectroscopy
Size-Dependent Raman Red Shifts of Semiconductor Nanocrystals
Molecular Fundamentals of Enzyme Nanogels
Proton-Coupled Electron Transfer in Solution, Proteins, and Electrochemistry
Hydrolysis of Ionized Deoxycholic Acid in the Aqueous Phase and Rate Analysis for Transfer of Neutralized Deoxycholic Acid into the Benzene Phase across the Benzene/Water Interface
Anesthetic Modulation of Protein Dynamics: Insight from an NMR Study
Probing Phenylalanine/Adenine π-Stacking Interactions in Protein Complexes with Explicitly Correlated and CCSD(T) Computations
Study of the Supramolecular Cooperativity in the Multirecognition Mechanism of Cyclodextrins/Cucurbituril/Disubstituted Diimidazolium Bromides
Rationalization of the Difference in Lifetime of Two Covalent Sialosyl−Enzyme Intermediates of Trypanosoma rangeli Sialidase
Incorporation of a QM/MM Buffer Zone in the Variational Double Self-Consistent Field Method
Molecular Weight Dependence of Hybrid Shish Kebab Structure in Injection Molded Bar of Polyethylene/Inorganic Whisker Composites
Excitation Wavelength Dependence of Primary Charge Separation in Reaction Centers from Rhodobacter sphaeroides
Theoretical Insight into the Intrinsic Ultrafast Formation of Cyclobutane Pyrimidine Dimers in UV-Irradiated DNA: Thymine versus Cytosine
Stochastic Liouville Equations for Coherent Multidimensional Spectroscopy of Excitons
Trace of the Interesting “V”-Shaped Dynamic Mechanism of Interactions between Water and Ionic Liquids
Thermodynamic Model for the Analysis of Calorimetric Data of Oligomeric Proteins
A Quantum Mechanics/Molecular Mechanics Study of the Protein−Ligand Interaction of Two Potent Inhibitors of Human O-GlcNAcase: PUGNAc and NAG-Thiazoline
Relay Stations for Electron Hole Migration in Peptides: Possibility for Formation of Three-Electron Bonds along Peptide Chains
A Molecular Dynamics Study of Alkaline Earth Metal−Chloride Complexation in Aqueous Solution
On the Molecular Mechanism of Water Reorientation
Molecular Dynamics Description of Grafted Monolayers: Effect of the Surface Coverage
Thermodynamic Assessment of Smectic A−Nematic Tricritical Points through the Equal Gibbs Energy Analysis
Interactions of Ibuprofen with Hybrid Lipid Bilayers Probed by Complementary Surface-Enhanced Vibrational Spectroscopies
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