Concepedia

Yanfei Guan

YG

19

Publications

1.8K

Citations

17

H-Index

2014

Active since

Affiliations

Massachusetts Institute of Technology(Current)

Texas A&M University

University of Georgia

National Renewable Energy Laboratory

Shanghai Jiao Tong University

Yanfei Guan is an author at Massachusetts Institute of Technology specializing in engineering, chemistry, and computational chemistry.

ORCID

Top concepts

Publications per year

2014–2023

19

Publications

19

Noncovalent Interactions in Organocatalysis and the Prospect of Computational Catalyst Design

Steven E. Wheeler, Trevor J. Seguin, Yanfei Guan et al. · Accounts of Chemical Research · 2016 · 389 citations

Prediction of organic homolytic bond dissociation enthalpies at near chemical accuracy with sub-second computational cost

Peter C. St. John, Yanfei Guan, Yeonjoon Kim et al. · Nature Communications · 2020 · 323 citations · Full text

AARON: An Automated Reaction Optimizer for New Catalysts

Yanfei Guan, Victoria M. Ingman, Benjamin J. Rooks et al. · Journal of Chemical Theory and Computation · 2018 · 163 citations

, , +16

Regio-selectivity prediction with a machine-learned reaction representation and on-the-fly quantum mechanical descriptors

Yanfei Guan, Connor W. Coley, Haoyang Wu et al. · Chemical Science · 2020 · 144 citations · Full text

Quantum chemical calculations for over 200,000 organic radical species and 40,000 associated closed-shell molecules

Peter C. St. John, Yanfei Guan, Yeonjoon Kim et al. · Scientific Data · 2020 · 134 citations · Full text

Rows per page

1–5 of 19