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Disambiguation of "Fedorov, Dmitri G."

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The Fragment Molecular Orbital Method Reveals New Insight into the Chemical Nature of GPCR-Ligand Interactions.

, , , , , , , and . J. Chem. Inf. Model., 56 (1): 159-172 (2016)

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Sergej Fedorov

Kirill Fedorov

Maxim Fedorov

Mikhail Fedorov

Andrej Fedorov

 

Other publications of authors with the same name

Implementation of replica-exchange umbrella sampling in GAMESS., , , and . Comput. Phys. Commun., (2018)The polarizable continuum model (PCM) interfaced with the fragment molecular orbital method (FMO)., , , , and . J. Comput. Chem., 27 (8): 976-985 (2006)Energy gradients in combined fragment molecular orbital and polarizable continuum model (FMO/PCM) calculation., , , , , and . J. Comput. Chem., 31 (4): 778-790 (2010)Three-body expansion of the fragment molecular orbital method combined with density-functional tight-binding., and . J. Comput. Chem., 38 (7): 406-418 (2017)Hotspot Identification and Drug Design of Protein-Protein Interaction Modulators Using the Fragment Molecular Orbital Method., , , , , and . J. Chem. Inf. Model., 62 (16): 3784-3799 (2022)Full Electron Calculation Beyond 20, 000 Atoms: Ground Electronic State of Photosynthetic Proteins., , , , , , , and . SC, page 10. IEEE Computer Society, (2005)A systematic study of minima in alanine dipeptide., , , and . J. Comput. Chem., 40 (2): 297-309 (2019)Change in a protein's electronic structure induced by an explicit solvent: An ab initio fragment molecular orbital study of ubiquitin., , , and . J. Comput. Chem., 28 (10): 1750-1762 (2007)Complete Guide to the Fragment Molecular Orbital Method in GAMESS - From One Atom to a Million, at your Service. WorldScientific, (2023)The Fragment Molecular Orbital Method Reveals New Insight into the Chemical Nature of GPCR-Ligand Interactions., , , , , , , and . J. Chem. Inf. Model., 56 (1): 159-172 (2016)