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Dmitri G Fedorov

Showing results (1-10 of 129) with videos related to

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The Journal of Chemical Physics|December 22, 2022
Parametrized quantum-mechanical approaches combined with the fragment molecular orbital methodDmitri G Fedorov
Physical Chemistry Chemical Physics : PCCP|June 26, 2024
Partition analysis of dipole moments in solution applied to functional groups in polypeptide motifsDmitri G Fedorov
The Journal of Physical Chemistry. A|February 1, 2024
Analysis of Site Energies and Excitonic Couplings: The Role of Symmetry and PolarizationDmitri G Fedorov
The Journal of Physical Chemistry. A|October 2, 2023
Site-Specific Ionization Potentials and Electron Affinities in Large Molecular Systems at Coupled Cluster LevelDmitri G Fedorov
The Journal of Chemical Physics|October 9, 2025
Polarization and basis set superposition error in interaction energies in the fragment molecular orbital methodDmitri G Fedorov
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|May 15, 2024
The Peptide Bond: Resonance Increases Bond Order and Complicates FragmentationDmitri G Fedorov
Journal of Computational Chemistry|April 21, 2022
Polarization energies in the fragment molecular orbital methodDmitri G Fedorov
Journal of Chemical Theory and Computation|August 29, 2019
Solvent Screening in Zwitterions Analyzed with the Fragment Molecular Orbital MethodDmitri G Fedorov
The Journal of Physical Chemistry. A|December 12, 2024
Importance of Charge Balance for the Embedding of Zwitterionic Solutes in the Fragment Molecular Orbital MethodDmitri G Fedorov
Methods in Molecular Biology (Clifton, N.J.)|February 5, 2020
Analyzing Interactions with the Fragment Molecular Orbital MethodDmitri G Fedorov
Pageof 13

Showing results (1-10 of 129) with videos related to

Sort By:
Pageof 13
The Journal of Chemical Physics|December 22, 2022
Parametrized quantum-mechanical approaches combined with the fragment molecular orbital methodDmitri G Fedorov
Physical Chemistry Chemical Physics : PCCP|June 26, 2024
Partition analysis of dipole moments in solution applied to functional groups in polypeptide motifsDmitri G Fedorov
The Journal of Physical Chemistry. A|February 1, 2024
Analysis of Site Energies and Excitonic Couplings: The Role of Symmetry and PolarizationDmitri G Fedorov
The Journal of Physical Chemistry. A|October 2, 2023
Site-Specific Ionization Potentials and Electron Affinities in Large Molecular Systems at Coupled Cluster LevelDmitri G Fedorov
The Journal of Chemical Physics|October 9, 2025
Polarization and basis set superposition error in interaction energies in the fragment molecular orbital methodDmitri G Fedorov
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|May 15, 2024
The Peptide Bond: Resonance Increases Bond Order and Complicates FragmentationDmitri G Fedorov
Journal of Computational Chemistry|April 21, 2022
Polarization energies in the fragment molecular orbital methodDmitri G Fedorov
Journal of Chemical Theory and Computation|August 29, 2019
Solvent Screening in Zwitterions Analyzed with the Fragment Molecular Orbital MethodDmitri G Fedorov
The Journal of Physical Chemistry. A|December 12, 2024
Importance of Charge Balance for the Embedding of Zwitterionic Solutes in the Fragment Molecular Orbital MethodDmitri G Fedorov
Methods in Molecular Biology (Clifton, N.J.)|February 5, 2020
Analyzing Interactions with the Fragment Molecular Orbital MethodDmitri G Fedorov
Pageof 13