Evgeny Epifanovsky

Physics and AstronomyMaterials ScienceBiochemistry, Genetics and Molecular BiologyComputer Science

Pilot corpus only

This score is computed over theSindex pilot corpus and does not cover the full scientific literature. Scores are relative to papers we have ingested — papers, authors, and institutions outside the pilot are not represented. Methodology.

Top 100%percentile

0Author DataRank

Indexed papers

0in pilot corpus

datarank_citation_only_1hop_v6· scope data_onlyMethodology

Papers

Driven by 9 papers. Top paper: “Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package”.

Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package

The Journal of Chemical Physics(2021)10.1063/5.0055522

N/A

0DataRank · unranked

1356 citations

Andrew T. B. Gilbert, Xintian Feng, Joonho Lee, Yuezhi Mao, Narbe Mardirossian +95 more

Machine-Learning-Assisted Free Energy Simulation of Solution-Phase and Enzyme Reactions

Journal of Chemical Theory and Computation(2021)10.1021/acs.jctc.1c00565

N/A

0DataRank · unranked

110 citations

Junjie Yang, Richard Van, Evgeny Epifanovsky, Junming Ho, Jing Huang +5 more

Machine Learning Assisted Free Energy Simulation of Solution–Phase and Enzyme Reactions

ChemRxiv(2021)10.26434/chemrxiv.14745510.v1

N/A

0DataRank · unranked

12 citations

Junjie Yang, Richard Van, Evgeny Epifanovsky, Junming Ho, Jing Huang +5 more

Approaching the basis set limit in Gaussian-orbital-based periodic calculations with transferability: Performance of pure density functionals for simple semiconductors

The Journal of Chemical Physics(2021)10.1063/5.0069177

N/A

0DataRank · unranked

0 citations

Xintian Feng, Leonardo A. Cunha, Jérôme F. Gonthier, Evgeny Epifanovsky, Martin Head‐Gordon +1 more

Machine Learning Assisted Free Energy Simulation of Solution–Phase and Enzyme Reactions

ChemRxiv(2021)10.26434/chemrxiv.14745510

N/A

0DataRank · unranked

0 citations

Junjie Yang, Richard Van, Evgeny Epifanovsky, Junming Ho, Jing Huang +5 more

Faster Exact Exchange for Solids via occ-RI-K: Application to Combinatorially Optimized Range-Separated Hybrid Functionals for Simple Solids with Pseudopotentials Near the Basis Set Limit

Journal of Chemical Theory and Computation(2022)10.1021/acs.jctc.2c00742

N/A

0DataRank · unranked

26 citations

Adam Rettig, Xintian Feng, Evgeny Epifanovsky, Martin Head‐Gordon, Joonho Lee

Accelerating Ab Initio Quantum Mechanical and Molecular Mechanical (QM/MM) Molecular Dynamics Simulations with Multiple Time Step Integration and a Recalibrated Semiempirical QM/MM Hamiltonian

The Journal of Physical Chemistry B(2022)10.1021/acs.jpcb.2c02262

N/A

0DataRank · unranked

21 citations

Richard Van, Evgeny Epifanovsky, Jian Liu, Jingzhi Pu, Kwangho Nam +2 more

M-Chem: a modular software package for molecular simulation that spans scientific domains

Molecular Physics(2022)10.1080/00268976.2022.2129500

N/A

0DataRank · unranked

6 citations

Joseph P. Heindel, Xingyi Guan, Itai Leven, Hongxia Hao, Pavithra M. Naullage +9 more

Accelerating ab initio QM/MM Molecular Dynamics Simulations with Multiple Time Step Integration and a Recalibrated Semi-empirical QM/MM Hamiltonian

ChemRxiv(2022)10.26434/chemrxiv-2022-0zg7j

N/A

0DataRank · unranked

2 citations

Richard Van, Evgeny Epifanovsky, Jian Liu, Jingzhi Pu, Kwangho Nam +2 more