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Publications by Swapnil Baral
Predicting Spectral Properties of Polarity Sensitive Dyes With QM/MM Simulation
Biophysical Journal
Biophysics
Related publications
Predicting Relative Binding Affinity Using Nonequilibrium QM/MM Simulations
A QM/MM and QM/QM/MM Study of Kerr, Cotton–Mouton and Jones Linear Birefringences in Liquid Acetonitrile
Physical Chemistry Chemical Physics
Theoretical Chemistry
Astronomy
Physics
Physical
Simulation of Adsorption Processes at Metallic Interfaces: An Image Charge Augmented QM/MM Approach
Journal of Chemical Theory and Computation
Theoretical Chemistry
Computer Science Applications
Physical
Nano Drug Delivery Study of Anticancer Properties on Ginger Using QM/MM Methods
Oriental Journal of Chemistry
Biochemistry
Environmental Chemistry
Drug Discovery
Chemistry
QM/MM Study of the Taxadiene Synthase Mechanism
Journal of Computational Chemistry
Computational Mathematics
Chemistry
Classical Polarization in Hybrid QM/MM Methods
QM/MM (ONIOM) Calculation on FAK/Dasatinib Docking
Revista Processos Químicos
Vibrational Analysis of Boldine Hydrochloride Using QM/MM Approach
Spectroscopy
Identifying Carboxylate Ligand Vibrational Modes in Photosystem II With QM/MM Methods
Proceedings of the National Academy of Sciences of the United States of America
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