Alexei Nikitin

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2019-2024
Publications (10 Years): 7

Top Topics

Atomic Force Microscopy

Convolutional Neural Network

Molecular Dynamics

Top Venues

Journal of chemical theory and computation

Journal of molecular modeling

Journal of computer-aided molecular design

Journal of computational chemistry

This page only lists publications with an associated author ORCID identifier.

Publications

Alexei Nikitin, Feng Wang
Simulation of Linear and Cyclic Alkanes with Second-Order Møller-Plesset Perturbation Theory through Adaptive Force Matching. Journal of chemical theory and computation 20 (12) (2024)
Alexei Nikitin, Feng Wang
Simulation of Linear and Cyclic Alkanes with Second-Order Møller-Plesset Perturbation Theory through Adaptive Force Matching. Journal of chemical theory and computation (2024)
Alexei Nikitin, Feng Wang
Simulation of Linear and Cyclic Alkanes with Second-Order Møller-Plesset Perturbation Theory through Adaptive Force Matching. Journal of chemical theory and computation 20 (12) (2024)
Alexei Nikitin, Feng Wang
Simulation of Linear and Cyclic Alkanes with Second-Order Møller-Plesset Perturbation Theory through Adaptive Force Matching. Journal of chemical theory and computation 20 (12) (2024)
Alexei Nikitin, Vladislava Milchevskaya, Alexander P Lyubartsev
To the fast calculation of the solvation free energy. Combining expanded ensembles with L2MC. Journal of computational chemistry 42 (11) (2021)
Alexei Nikitin, Vladimir Chekhov
Partial charges for molecular-mechanical models of heterocyclic compounds: pyridine nitrogen. Journal of molecular modeling 27 (5) (2021)
Alexei Nikitin
Non-zero Lennard-Jones parameters for the Toukan-Rahman water model: more accurate calculations of the solvation free energy of organic substances. Journal of computer-aided molecular design 34 (4) (2019)