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I. Self-Assembly of Thioether-Modified Cationic Surfactants
II. Electrostatic Binding among Equilibrating 2-D and 3-D
Self-Assemblies
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Orientation and Vibrational Dynamics of Rhenium Bipyridyl
CO2-Reduction Catalysts on Model Electrode
Surfaces
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Efficient implementations of quantum chemistry methods for strongly
correlated electrons
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Simulations of Lipid Sorting Effects near Transmembrane
Peptide
4 of 10
Quantum Confined Semiconductor Nanocrystals for Efficient Charge
Separation and Solar-to-fuel Conversion
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Recombinant Site Specific Labeling of Proteins with IR Probes
6 of 10
Dynamics Calculations of Several Atmospheric Reactions on Global
Potential Energy Surfaces
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Interfacial Electron Transfer Dynamics between Organic Molecular
Adsorbates and Semiconductor Nanoparticles
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Theoretical Studies of Unusual Molecular Vibrational
Dynamics
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Validation of Receptor-Based Drug Design and Applications in the
Study of IKKs, Truncated Taxane and LRH-1
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