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Publications by Hongxing Lei
Development of Polarizable Models for Molecular Mechanical Calculations II: Induced Dipole Models Significantly Improve Accuracy of Intermolecular Interaction Energies
Journal of Physical Chemistry B
Surfaces
Theoretical Chemistry
Materials Chemistry
Films
Medicine
Coatings
Physical
Multiple Roles of a Conserved GAF Domain Tyrosine Residue in Cyanobacterial and Plant Phytochromes†
Biochemistry
Biochemistry
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Development of Polarizable Models for Molecular Mechanical Calculations. 3. Polarizable Water Models Conforming to Thole Polarization Screening Schemes
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Molecular Dynamics of Polarizable Point Dipole Models for Molten NaI. Comparison With First Principles Simulations
EPJ Web of Conferences
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Perspective: Polarizable Continuum Models for Quantum-Mechanical Descriptions
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Intermolecular Interaction Energies in Molecular Crystals of 4-Formylcoumarin Derivatives
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Comparison of Polarizable Continuum & Quantum Mechanics/Molecular Mechanics Models With Series of Tripeptides (AXA)
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Explicitly Correlated Intermolecular Distances and Interaction Energies of Hydrogen Bonded Complexes
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Randomized SMILES Strings Improve the Quality of Molecular Generative Models
Development of Predictive Models of the Kinetics of a Hydrogen Abstraction Reaction Combining Quantum-Mechanical Calculations and Experimental Data
Industrial & Engineering Chemistry Research
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Predicting the Viscosity of Alkanes Using Nonequilibrium Molecular Dynamics: Evaluation of Intermolecular Potential Models
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