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Publications in Theoretical Chemistry
Theoretical Study on the Hydrophobic and Hydrophilic Hydration on Large Solutes: The Case of Phthalocyanines in Water
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
Publisher's Note: “Communication: Theoretical Exploration of Au+ + H2, D2, and HD Reactive Collisions” [J. Chem. Phys. 135, 091102 (2011)]
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
Spin-Dependent Polaron Recombination in Conjugated Polymers
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
The Interaction of CO With a Copper(II) Chloride Oxy-Chlorination Catalyst
Faraday Discussions
Theoretical Chemistry
Physical
Direct Quantum Dynamics Using Variational Gaussian Wavepackets and Gaussian Process Regression
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
From Synthetic DNA to PCR Product: Detection of Fungal Infections Using SERS
Faraday Discussions
Theoretical Chemistry
Physical
Hard Convex Lens-Shaped Particles: Densest-Known Packings and Phase Behavior
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
Probing the Folded State and Mechanical Unfolding Pathways of T4 Lysozyme Using All-Atom and Coarse-Grained Molecular Simulation
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
Publisher’s Note: “Electronic Energy Transfer Through Non-Adiabatic Vibrational-Electronic Resonance. II. 1D Spectra for a Dimer” [J. Chem. Phys. 148, 084308 (2018)]
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
The Small-Voxel Tracking Algorithm for Simulating Chemical Reactions Among Diffusing Molecules
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
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