SCOPUS 정보 검색 플랫폼

Volumn 14, Issue 16, 2008, Pages 5039-5046

Estimating the temperature dependence of peptide folding entropies and free enthalpies from total energies in molecular dynamics simulations

(3) Boned, Ricard a Van Gunsteren, Wilfred F b Daura, Xavier a,c

a UNIVERSITAT AUTÒNOMA DE BARCELONA (Spain)

b ETH ZURICH (Switzerland)

c INSTITUCIÓ CATALANA DE RECERCA I ESTUDIS AVANÇATS ICREA (Spain)

Author keywords

GROMOS; Molecular dynamics; Peptide folding; Peptides; Thermodynamics

Indexed keywords

AMINES; DYNAMICS; ENTHALPY; ENTROPY; MECHANICS; METHANOL; MOLECULAR DYNAMICS; NANOFLUIDICS; QUANTUM CHEMISTRY; SPECIFIC HEAT; STATISTICAL MECHANICS; TEMPERATURE DISTRIBUTION;

CONFORMATIONAL DISTRIBUTIONS; FORCE FIELDS; FREE ENTHALPY; GROMOS; HEAT CAPACITIES; HEPTAPEPTIDE; MOLECULAR DYNAMICS SIMULATIONS; MOLECULAR SIMULATIONS; MOLECULAR SYSTEMS; PEPTIDE FOLDING; PEPTIDES; TEMPERATURE DEPENDENCES; TOTAL ENERGIES;

THERMODYNAMICS;

PEPTIDE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; PROTEIN FOLDING; TEMPERATURE; THERMODYNAMICS;

MODELS, MOLECULAR; PEPTIDES; PROTEIN FOLDING; TEMPERATURE; THERMODYNAMICS;

EID: 53849083470 PISSN: 09476539 EISSN: 15213765 Source Type: Journal
DOI: 10.1002/chem.200701380 Document Type: Article

Times cited : (15)

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