Chris Chipot

Cited by

	All	Since 2016
Citations	26447	12468
h-index	55	35
i10-index	169	115

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Co-authors

Klaus SchultenProfessor of Physics, University of Illinois at Urbana-ChampaignVerified email at ks.uiuc.edu
François DehezCNRS , University of LorraineVerified email at univ-lorraine.fr
James C. GumbartGeorgia TechVerified email at physics.gatech.edu
James C PhillipsSenior Research Programmer, National Center for Supercomputing Applications, University of IllinoisVerified email at illinois.edu
Emad Tajkhorshid, PhDProfessor of Biochemistry and Biophysics, University of IllinoisVerified email at illinois.edu
Laxmikant KaleProfessor or Computer Science, University of IllinoisVerified email at illinois.edu
Jérôme HéninCNRS, IBPCVerified email at ibpc.fr
Jeffrey ComerKansas State UniversityVerified email at ksu.edu
Benoit RouxProfessor of Biochemistry, The university of ChicagoVerified email at uchicago.edu
Rosemary BraunAssociate Professor - Molecular Biosciences, Applied Math, & Physics - Northwestern UniversityVerified email at northwestern.edu
János G. ÁngyánCRM2 CNRS & Université de LorraineVerified email at univ-lorraine.fr
Mounir TarekCNRS- Université de Lorraine, Nancy FranceVerified email at univ-lorraine.fr
Javier LuqueUniversity of Barcelona - Institut of BiomedicineVerified email at ub.edu
David A PearlmanQSimulateVerified email at alumni.stanford.edu
LELIEVRE, TONYProfessor of Applied Mathematics, Ecole des Ponts ParisTech and INRIAVerified email at cermics.enpc.fr
Jean-Louis RivailUniversité de LorraineVerified email at univ-lorraine.fr
Wendy D CornellIBMVerified email at us.ibm.com
Ignacio Soteras GutiérrezData Analytics mentorVerified email at ubiqum.com
Yi WangAssociate professor, Chinese University of Hong KongVerified email at cuhk.edu.hk
Liu YingzheXi'an Modern Chemistry InstituteVerified email at mail.nankai.edu.cn

Chris Chipot

University of Lorraine — University of Illinois, Urbana-Champaign

Verified email at Univ-Lorraine.fr - Homepage

Computational biophysics


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Scalable molecular dynamics with NAMD JC Phillips, R Braun, W Wang, J Gumbart, E Tajkhorshid, E Villa, C Chipot, ... Journal of computational chemistry 26 (16), 1781-1802, 2005	14955	2005
Free energy calculations C Chipot, A Pohorille Springer-Verlag Berlin Heidelberg, 2007	1089	2007
Good practices in free-energy calculations A Pohorille, C Jarzynski, C Chipot The Journal of Physical Chemistry B 114 (32), 10235-10253, 2010	491	2010
Overcoming free energy barriers using unconstrained molecular dynamics simulations J Hénin, C Chipot The Journal of chemical physics 121 (7), 2904-2914, 2004	455	2004
Encyclopedia of computational chemistry P von Ragué Schleyer, PR Schreiner, HF Schaefer III, WL Jorgensen, ...	391	1998
Benzene dimer: A good model for π− π interactions in proteins? A comparison between the benzene and the toluene dimers in the gas phase and in an aqueous solution C Chipot, R Jaffe, B Maigret, DA Pearlman, PA Kollman Journal of the American Chemical Society 118 (45), 11217-11224, 1996	367	1996
Exploring multidimensional free energy landscapes using time-dependent biases on collective variables J Henin, G Fiorin, C Chipot, ML Klein Journal of chemical theory and computation 6 (1), 35-47, 2010	355	2010
The development/application of a ‘minimalist’ organic/biochemical molecular mechanic force field using a combination of ab initio calculations and experimental data PA Kollman, R Dixon, W Cornell, T Fox, C Chipot, A Pohorille Computer Simulations of Biomolecular Systems, 83-96, 1997	258	1997
Standard binding free energies from computer simulations: What is the best strategy? JC Gumbart, B Roux, C Chipot Journal of chemical theory and computation 9 (1), 794-802, 2013	251	2013
The adaptive biasing force method: Everything you always wanted to know but were afraid to ask J Comer, JC Gumbart, J Hénin, T Lelièvre, A Pohorille, C Chipot The Journal of Physical Chemistry B 119 (3), 1129-1151, 2015	243	2015
Cation− π interactions in proteins: can simple models provide an accurate description? H Minoux, C Chipot Journal of the American Chemical Society 121 (44), 10366-10372, 1999	211	1999
Insights into the recognition and association of transmembrane α-helices. The free energy of α-helix dimerization in glycophorin A J Hénin, A Pohorille, C Chipot Journal of the American Chemical Society 127 (23), 8478-8484, 2005	148	2005
NMR structure and ion channel activity of the p7 protein from hepatitis C virus R Montserret, N Saint, C Vanbelle, AG Salvay, JP Simorre, C Ebel, ... Journal of Biological Chemistry 285 (41), 31446-31461, 2010	144	2010
Efficient determination of protein–protein standard binding free energies from first principles JC Gumbart, B Roux, C Chipot Journal of chemical theory and computation 9 (8), 3789-3798, 2013	139	2013
Frontiers in free‐energy calculations of biological systems C Chipot Wiley Interdisciplinary Reviews: Computational Molecular Science 4 (1), 71-89, 2014	132	2014
Free energy calculations. The long and winding gilded road C Chipot, DA Pearlman Molecular Simulation 28 (1-2), 1-12, 2002	129	2002
Exploring the free-energy landscape of a short peptide using an average force C Chipot, J Hénin The Journal of chemical physics 123 (24), 244906, 2005	128	2005
Theory and applications in chemistry and biology FE Calculations Chipot, C., Pohorille, A., Eds, 2007	127	2007
Simulation-based approaches for determining membrane permeability of small compounds CT Lee, J Comer, C Herndon, N Leung, A Pavlova, RV Swift, C Tung, ... Journal of chemical information and modeling 56 (4), 721-733, 2016	126	2016
A toolkit for the analysis of free-energy perturbation calculations P Liu, F Dehez, W Cai, C Chipot Journal of chemical theory and computation 8 (8), 2606-2616, 2012	121	2012

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