Roberto Lins
Roberto Lins üzerinde doğrulanmış e-posta adresine sahip - Ana Sayfa
Alıntı yapanlar
Alıntı yapanlar
A new GROMOS force field for hexopyranose‐based carbohydrates
RD Lins, PH Hünenberger
Journal of computational chemistry 26 (13), 1400-1412, 2005
Developing a dynamic pharmacophore model for HIV-1 integrase
HA Carlson, KM Masukawa, K Rubins, FD Bushman, WL Jorgensen, ...
Journal of medicinal chemistry 43 (11), 2100-2114, 2000
Trehalose–protein interaction in aqueous solution
RD Lins, CS Pereira, PH Hünenberger
Proteins: Structure, Function, and Bioinformatics 55 (1), 177-186, 2004
A consistent potential energy parameter set for lipids: dipalmitoylphosphatidylcholine as a benchmark of the GROMOS96 45A3 force field
I Chandrasekhar, M Kastenholz, RD Lins, C Oostenbrink, LD Schuler, ...
European Biophysics Journal 32 (1), 67-77, 2003
Interaction of the disaccharide trehalose with a phospholipid bilayer: a molecular dynamics study
CS Pereira, RD Lins, I Chandrasekhar, LCG Freitas, PH Hünenberger
Biophysical Journal 86 (4), 2273-2285, 2004
An improved nucleic acid parameter set for the GROMOS force field
TA Soares, PH Hünenberger, MA Kastenholz, V Kräutler, T Lenz, RD Lins, ...
Journal of computational chemistry 26 (7), 725-737, 2005
Characterization of chitin and chitosan molecular structure in aqueous solution
EF Franca, RD Lins, LCG Freitas, TP Straatsma
Journal of Chemical Theory and Computation 4 (12), 2141-2149, 2008
Computer simulation of the rough lipopolysaccharide membrane of Pseudomonas aeruginosa
RD Lins, TP Straatsma
Biophysical journal 81 (2), 1037-1046, 2001
Variational particle number approach for rational compound design
OA von Lilienfeld, RD Lins, U Rothlisberger
Physical review letters 95 (15), 153002, 2005
GROMOS 53A6GLYC, an Improved GROMOS Force Field for Hexopyranose-Based Carbohydrates
L Pol-Fachin, VH Rusu, H Verli, RD Lins
Journal of Chemical Theory and Computation 8 (11), 4681-4690, 2012
A glycam-based force field for simulations of lipopolysaccharide membranes: parametrization and validation
KN Kirschner, RD Lins, A Maass, TA Soares
Journal of chemical theory and computation 8 (11), 4719-4731, 2012
Chitosan molecular structure as a function of N‐acetylation
EF Franca, LCG Freitas, RD Lins
Biopolymers 95 (7), 448-460, 2011
Molecular dynamics studies on the HIV-1 integrase catalytic domain
RD Lins, JM Briggs, TP Straatsma, HA Carlson, J Greenwald, S Choe, ...
Biophysical journal 76 (6), 2999-3011, 1999
In vitro evolution of a peptide with a hematite binding motif that may constitute a natural metal-oxide binding archetype
BH Lower, RD Lins, Z Oestreicher, TP Straatsma, MF Hochella Jr, L Shi, ...
Environmental science & technology 42 (10), 3821-3827, 2008
Prediction of HIV-1 integrase/viral DNA interactions in the catalytic domain by fast molecular docking
AA Adesokan, VA Roberts, KW Lee, RD Lins, JM Briggs
Journal of medicinal chemistry 47 (4), 821-828, 2004
Polymorphisms in fibronectin binding protein A of Staphylococcus aureus are associated with infection of cardiovascular devices
SK Lower, S Lamlertthon, NN Casillas-Ituarte, RD Lins, R Yongsunthon, ...
Proceedings of the National Academy of Sciences 108 (45), 18372-18377, 2011
The effect of temperature, cations, and number of acyl chains on the lamellar to non-lamellar transition in lipid-A membranes: a microscopic view
FJS Pontes, VH Rusu, TA Soares, RD Lins
Journal of chemical theory and computation 8 (10), 3830-3838, 2012
Hydration, ionic valence and cross-linking propensities of cations determine the stability of lipopolysaccharide (LPS) membranes
A Nascimento, FJS Pontes, RD Lins, TA Soares
Chemical communications 50 (2), 231-233, 2014
Computer Simulation of Uranyl Uptake by the Rough Lipopolysaccharide Membrane of Pseudomonas aeruginosa
RD Lins, ER Vorpagel, M Guglielmi, TP Straatsma
Biomacromolecules 9 (1), 29-35, 2008
Protein under pressure: molecular dynamics simulation of the arc repressor
D Trzesniak, RD Lins, WF van Gunsteren
Proteins: Structure, Function, and Bioinformatics 65 (1), 136-144, 2006
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Makaleler 1–20