Charles L. Brooks III

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Michael FeigMichigan State UniversityPotvrđena adresa e-pošte na msu.edu
Wonpil ImPresidential Endowed Chair and Professor of Biological Sciences, Lehigh UniversityPotvrđena adresa e-pošte na lehigh.edu
Douglas TobiasDepartment of Chemistry, UC IrvinePotvrđena adresa e-pošte na uci.edu
John E. JohnsonThe Scripps Research InstitutePotvrđena adresa e-pošte na scripps.edu
Sandeep Patel, Ph.D.University of Delaware Department of Chemistry/BiochemistryPotvrđena adresa e-pošte na udel.edu
John KaranicolasMolecular Therapeutics Program, Fox Chase Cancer CenterPotvrđena adresa e-pošte na fccc.edu
Anthony MustoeAssistant Professor, Baylor College of MedicinePotvrđena adresa e-pošte na bcm.edu
Zhan Chenuniversity of MichiganPotvrđena adresa e-pošte na umich.edu
Michela TauferJack Dongarra Professor in High Performance Computing, The University of TennesseePotvrđena adresa e-pošte na acm.org
Jonathan HirstProfessor of Computational Chemistry, University of NottinghamPotvrđena adresa e-pošte na nottingham.ac.uk
Jose OnuchicCTBP Rice UniversityPotvrđena adresa e-pošte na rice.edu
Michael LeeU.S. Army Research LaboratoryPotvrđena adresa e-pošte na mail.mil
Andrzej KolinskiProfessor, University of WarsawPotvrđena adresa e-pošte na chem.uw.edu.pl
Alex DicksonAssociate Professor, Department of Biochemistry & Molecular Biology, Michigan State UniversityPotvrđena adresa e-pošte na msu.edu
Michael F CrowleyPrincipal Scientist, National Renewable Energy LaboratoryPotvrđena adresa e-pošte na nrel.gov
Jeffrey SkolnickGeorgia Institute of TechnologyPotvrđena adresa e-pošte na gatech.edu
Eric R MayAssociate Professor, University of ConnecticutPotvrđena adresa e-pošte na uconn.edu
Sean M. LawPrincipal Data Scientist, R&D - Charles SchwabPotvrđena adresa e-pošte na schwab.com
Benoit RouxProfessor of Biochemistry, The university of ChicagoPotvrđena adresa e-pošte na uchicago.edu
Ronald D. Hills Jr.University of New England, Department of Pharmaceutical Sciences & AdministrationPotvrđena adresa e-pošte na une.edu

Prati

Charles L. Brooks III

Cyrus Levinthal Distinguished University Professor of Chemistry and Biophysics; Warner-Lambert/Parke

Potvrđena adresa e-pošte na umich.edu - Početna stranica

Computational and theoretical chemistry and biophysics


Naslov Poredaj po navodima Poredaj po godini Poredaj po naslovu	Citirano Citirano	Godina
CHARMM: the biomolecular simulation program BR Brooks, CL Brooks III, AD Mackerell Jr, L Nilsson, RJ Petrella, B Roux, ... Journal of computational chemistry 30 (10), 1545-1614, 2009	9407	2009
Extending the treatment of backbone energetics in protein force fields: Limitations of gas‐phase quantum mechanics in reproducing protein conformational distributions in … AD Mackerell Jr, M Feig, CL Brooks III Journal of computational chemistry 25 (11), 1400-1415, 2004	3907	2004
Proteins: a theoretical perspective of dynamics, structure and thermodynamics CL Brooks III, M Karplus, B Montgomery Pettitt, RH Austin Physics Today 43 (2), 120-122, 1990	1741	1990
Detailed analysis of grid‐based molecular docking: A case study of CDOCKER—A CHARMm‐based MD docking algorithm G Wu, DH Robertson, CL Brooks III, M Vieth Journal of computational chemistry 24 (13), 1549-1562, 2003	1645	2003
CHARMM: the energy function and its parameterization AD MacKerell Jr, B Brooks, CL Brooks III, L Nilsson, B Roux, Y Won, ... Encyclopedia of computational chemistry 1, 2002	1540*	2002
A modified TIP3P water potential for simulation with Ewald summation DJ Price, CL Brooks III The Journal of chemical physics 121 (20), 10096-10103, 2004	1458	2004
Improved treatment of the protein backbone in empirical force fields AD MacKerell Jr, M Feig, CL Brooks Journal of the American Chemical Society 126 (3), 698-699, 2004	1131	2004
MMTSB Tool Set: enhanced sampling and multiscale modeling methods for applications in structural biology M Feig, J Karanicolas, CL Brooks III Journal of Molecular Graphics and Modelling 22 (5), 377-395, 2004	976	2004
Generalized born model with a simple smoothing function W Im, MS Lee, CL Brooks III Journal of computational chemistry 24 (14), 1691-1702, 2003	798	2003
Stochastic boundary conditions for molecular dynamics simulations of ST2 water A Brünger, CL Brooks III, M Karplus Chemical physics letters 105 (5), 495-500, 1984	760	1984
Performance comparison of generalized born and Poisson methods in the calculation of electrostatic solvation energies for protein structures M Feig, A Onufriev, MS Lee, W Im, DA Case, CL Brooks III Journal of computational chemistry 25 (2), 265-284, 2004	750	2004
Recent advances in the development and application of implicit solvent models in biomolecule simulations M Feig, CL Brooks III Current opinion in structural biology 14 (2), 217-224, 2004	707	2004
FROM FOLDING THEORIES TO FOLDING PROTEINS: A Review and Assessment of Simulation Studies of Protein Folding and Unfolding JE Shea, CL Brooks III Annual review of physical chemistry 52 (1), 499-535, 2001	637	2001
Deformable stochastic boundaries in molecular dynamics CL Brooks Iii, M Karplus The Journal of chemical physics 79 (12), 6312-6325, 1983	628	1983
New analytic approximation to the standard molecular volume definition and its application to generalized Born calculations MS Lee, M Feig, FR Salsbury Jr, CL Brooks III Journal of computational chemistry 24 (11), 1348-1356, 2003	624	2003
Assessing scoring functions for protein− ligand interactions P Ferrara, H Gohlke, DJ Price, G Klebe, CL Brooks Journal of medicinal chemistry 47 (12), 3032-3047, 2004	613	2004
CHARMM fluctuating charge force field for proteins: I parameterization and application to bulk organic liquid simulations S Patel, CL Brooks III Journal of computational chemistry 25 (1), 1-16, 2004	592	2004
Novel generalized Born methods MS Lee, FR Salsbury Jr, CL Brooks III The Journal of chemical physics 116 (24), 10606-10614, 2002	567	2002
CHARMM fluctuating charge force field for proteins: II protein/solvent properties from molecular dynamics simulations using a nonadditive electrostatic model S Patel, AD Mackerell Jr, CL Brooks III Journal of computational chemistry 25 (12), 1504-1514, 2004	561	2004
Comparative study of several algorithms for flexible ligand docking BD Bursulaya, M Totrov, R Abagyan, CL Brooks Journal of computer-aided molecular design 17, 755-763, 2003	523	2003

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