Benjamin R. Jagger

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Publications

Citations

256

H-Index

Active since

2017

Affiliations

University of California San Diego(Current)

Benjamin R. Jagger is an author at University of California San Diego specializing in brownian dynamics simulation, protein-ligand binding kinetics, and chemistry.

ORCID

Publications per year

2017–2020

Publications

SEEKR: Simulation Enabled Estimation of Kinetic Rates, A Computational Tool to Estimate Molecular Kinetics and Its Application to Trypsin–Benzamidine Binding

Lane Votapka, Benjamin R. Jagger, Alexandra L. Heyneman et al. · The Journal of Physical Chemistry B · 2017 · 101 citations

Natural Sciences, Biophysics, Chemistry +17

Predicting Ligand Binding Kinetics Using a Markovian Milestoning with Voronoi Tessellations Multiscale Approach

Benjamin R. Jagger, Anupam Anand Ojha, Rommie E. Amaro · Journal of Chemical Theory and Computation · 2020 · 52 citations

Natural Sciences, Chemistry, Medicinal Chemistry +17

Quantitative Ranking of Ligand Binding Kinetics with a Multiscale Milestoning Simulation Approach

Benjamin R. Jagger, Christopher T. Lee, Rommie E. Amaro · The Journal of Physical Chemistry Letters · 2018 · 45 citations · Full text

Natural Sciences, Chemistry, Medicinal Chemistry +17

Ranking of Ligand Binding Kinetics Using a Weighted Ensemble Approach and Comparison with a Multiscale Milestoning Approach

Surl-Hee Ahn, Benjamin R. Jagger, Rommie E. Amaro · Journal of Chemical Information and Modeling · 2020 · 33 citations · Full text

Pharmacy, Chemistry, Medicinal Chemistry +17

Predicting Ligand Binding Kinetics Using a Markovian Milestoning with Voronoi Tessellations Multiscale Approach

Benjamin R. Jagger, Anupam Anand Ojha, Rommie E. Amaro · ChemRxiv · 2020 · 25 citations · Full text

Natural Sciences, Chemistry, Medicinal Chemistry +17

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