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Robert Abel

Schrodinger (United States)

ORCID: 0000-0003-2945-3145

Publishes on Computational Drug Discovery Methods, Protein Structure and Dynamics, Machine Learning in Materials Science. 157 papers and 23.6k citations.

PubIndex Score84Top 16% · seniorHow it's scored

157Publications

23.6kTotal Citations

First publication: 1986First senior author: 1986

Computational Drug Discovery Methods Protein Structure and Dynamics Machine Learning in Materials Science Chemical Synthesis and Analysis Mass Spectrometry Techniques and Applications

Top publicationsby citations

Comparison of multiple Amber force fields and development of improved protein backbone parameters

Viktor Horn̆ák, Carlos Simmerling, Robert Abel et al.|Proteins Structure Function and Bioinformatics|2006

Cited by 7.1k

OPLS3: A Force Field Providing Broad Coverage of Drug-like Small Molecules and Proteins

Edward Harder, Richard A. Friesner, Wolfgang Damm et al.|Journal of Chemical Theory and Computation|2015

Cited by 3.1k

OPLS4: Improving Force Field Accuracy on Challenging Regimes of Chemical Space

Chao Lü, Edward Harder, Chuanjie Wu et al.|Journal of Chemical Theory and Computation|2021

Cited by 1.9k

Accurate and Reliable Prediction of Relative Ligand Binding Potency in Prospective Drug Discovery by Way of a Modern Free-Energy Calculation Protocol and Force Field

Lingle Wang, Robert Abel, Leah L. Frye et al.|Journal of the American Chemical Society|2015

Cited by 1.4k

OPLS3e: Extending Force Field Coverage for Drug-Like Small Molecules

Katarina Roos, Edward Harder, Chuanjie Wu et al.|Journal of Chemical Theory and Computation|2019

Cited by 1.3k