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D

Dmitry A. Shulga

Lomonosov Moscow State University

9H-index
55Paper Count
273Citation Count
Published Papers 9
Publication Date
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On the importance of explicit description of inductive effect among the other effects in drug-like molecules
errTheoretical Chemistry Accounts
IF1.5
err2026-05-01
err0
PREAI
errFrolov, Vitaly S.; Shulga, Dmitry A.; Shaimardanov, Arslan R.; Palyulin, Vladimir A.
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In silico studies of the open form of human tissue transglutaminase
errSCIENTIFIC REPORTS
IF3.9
err2024-07-10
err0
errOAAI
errIvashchenko, S. D.; Shulga, D. A.; Ivashchenko, V. D.; Zinovev, E. V.; Vlasov, A. V.
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errSave
Do electrostatic interactions make a difference in physics-based AutoDock4 scoring function?
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2024-04-25
err2
PREAI
errShaimardanov, Arslan R.; Shulga, Dmitry A.; Palyulin, Vladimir A.
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errSave
On hidden anisotropy of formally charged fragments
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2023-02-14
err2
PREAI
errShaimardanov, Arslan R.; Shulga, Dmitry A.; Palyulin, Vladimir A.
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errSave
Theoretical Studies of Leu-Pro-Arg-Asp-Ala Pentapeptide (LPRDA) Binding to Sortase A of Staphylococcus aureus
errMOLECULES
IF4.6
err2022-11-24
err8
errOAAI
errShulga, Dmitry A. A.; Kudryavtsev, Konstantin V. V.
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errSave
In Silico Structure-Based Approach for Group Efficiency Estimation in Fragment-Based Drug Design Using Evaluation of Fragment Contributions
errMOLECULES
IF4.6
err2022-03-18
err6
errOAAI
errShulga, Dmitry A.; Ivanov, Nikita N.; Palyulin, Vladimir A.
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errSave
Selection of Promising Novel Fragment Sized S. aureus SrtA Noncovalent Inhibitors Based on QSAR and Docking Modeling Studies
errMOLECULES
IF4.6
err2021-12-19
err9
errOAAI
errShulga, Dmitry A.; Kudryavtsev, Konstantin V.
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Iterative Solvers for Empirical Partial Atomic Charges: Breaking the Curse of Cubic Numerical Complexity
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2019-03-18
err2
PREAI
errShaimardanov, Arslan R.; Shulga, Dmitry A.; Palyulin, Vladimir A.
errShare
errSave
Quadrupole Correction: From Molecular Electrostatic Potential to Free Energies of Halogen Bonding
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2018-12-21
err13
PREAI
errTitov, Oleg I.; Shulga, Dmitry A.; Palyulin, Vladimir A.
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errSave

Research Directions

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Co-authors
Cooperation Journals
V
Vladimir A. Palyulin
H-index: 34 · Papers: 390
A
A.V. Vlasov
H-index: 18 · Papers: 111
K
Konstantin V. Kudryavtsev
H-index: 13 · Papers: 143
E
Egor V. Zinovev
H-index: 10 · Papers: 34
O
O. I. Titov
H-index: 5 · Papers: 8
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