Eric H. Knoll

Statistics

Publications

Citations

11.2K

H-Index

Active since

2004

Affiliations

Columbia University(Current)

Schrodinger (United States)

D. E. Shaw Research

Eric H. Knoll is an author at Columbia University specializing in computational chemistry, molecular orbital analysis, and electronic structure corrections.

Publications per year

2004–2006

Publications

Glide: A New Approach for Rapid, Accurate Docking and Scoring. 1. Method and Assessment of Docking Accuracy

Richard A. Friesner, Jay L. Banks, Robert B. Murphy et al. · Journal of Medicinal Chemistry · 2004 · 9.9K citations

Life Sciences, Biophysics, Medicinal Chemistry +17

PHASE: a new engine for pharmacophore perception, 3D QSAR model development, and 3D database screening: 1. Methodology and preliminary results

Steven L. Dixon, Alexander M. Smondyrev, Eric H. Knoll et al. · Journal of Computer-Aided Molecular Design · 2006 · 1.2K citations

Pharmacy, Medicinal Chemistry, Pharmacology +17

A localized orbital analysis of the thermochemical errors in hybrid density functional theory: Achieving chemical accuracy via a simple empirical correction scheme

Richard A. Friesner, Eric H. Knoll, Yixiang Cao · The Journal of Chemical Physics · 2006 · 68 citations

Natural Sciences, Chemistry, Physics +17

Localized Orbital Corrections for the Calculation of Ionization Potentials and Electron Affinities in Density Functional Theory

Eric H. Knoll, Richard A. Friesner · The Journal of Physical Chemistry B · 2006 · 33 citations

Natural Sciences, Chemistry, Physics +16

1–4 of 4