Publications by authors named "Benjamin P Roberts"

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Detecting and Mapping Invasive Species Across Riparian Corridors via Object Detection Approaches in UAV Imagery: An Example of .
Jack Cook, Benjamin P Roberts, Frédéric Labrosse, Neal Snooke

Ecol Evol· August 2025

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PUPIL: A Software Integration System for Multi-Scale QM/MM-MD Simulations and Its Application to Biomolecular Systems.
Juan Torras, Benjamin P Roberts, Gustavo M Seabra, Samuel B Trickey

Adv Protein Chem Struct Biol· July 2016

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Rational Design of Particle Mesh Ewald Compatible Lennard-Jones Parameters for +2 Metal Cations in Explicit Solvent.
Pengfei Li, Benjamin P Roberts, Dhruva K Chakravorty, Kenneth M Merz

J Chem Theory Comput· June 2013

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Comment on "A minimal implementation of the AMBER-GAUSSIAN interface for ab initio QM/MM-MD simulation".
Benjamin P Roberts, Gustavo M Seabra, Adrian E Roitberg, Kenneth M Merz, Erik Deumens

J Comput Chem· July 2012

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Wide-open flaps are key to urease activity.
Benjamin P Roberts, Bill R Miller, Adrian E Roitberg, Kenneth M Merz

J Am Chem Soc· June 2012

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The energy computation paradox and ab initio protein folding.
John C Faver, Mark L Benson, Xiao He, Benjamin P Roberts, Bing Wang

PLoS One· April 2011

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Formal Estimation of Errors in Computed Absolute Interaction Energies of Protein-ligand Complexes.
John C Faver, Mark L Benson, Xiao He, Benjamin P Roberts, Bing Wang

J Chem Theory Comput· March 2011

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Novel acyclic diaminocarbene ligands with increased steric demand and their application in gold catalysis.
Hwimin Seo, Benjamin P Roberts, Khalil A Abboud, Kenneth M Merz, Sukwon Hong

Org Lett· November 2010

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