SCOPUS 정보 검색 플랫폼

Volumn 36, Issue 13, 2015, Pages 970-982

Comparison of structural, thermodynamic, kinetic and mass transport properties of Mg2+ ion models commonly used in biomolecular simulations

(3) Panteva, Maria T a Giambaşu, George M a York, Darrin M a

a RUTGERS UNIVERSITY (United States)

Author keywords

benchmark; magnesium; molecular dynamics; pairwise potentials; parametrization

Indexed keywords

BENCHMARKING; BINDING SITES; BIOINFORMATICS; DISTRIBUTION FUNCTIONS; FREE ENERGY; MAGNESIUM; METAL IONS; METALS; MOLECULAR BIOLOGY; MOLECULAR DYNAMICS; NUCLEIC ACIDS; SOLUTIONS; TRANSPORT PROPERTIES;

BENCHMARK CALCULATIONS; BIOMOLECULAR SIMULATION; DISPERSION INTERACTION; MOLECULAR SIMULATIONS; NUCLEIC ACID STRUCTURE; PARAMETRIZATIONS; RADIAL DISTRIBUTION FUNCTIONS; SOLVATION FREE ENERGIES;

ION EXCHANGE;

MAGNESIUM;

CHEMICAL ACCIDENT; CHEMISTRY; COMPUTER SIMULATION; KINETICS; METABOLISM; THERMODYNAMICS;

CHEMICAL HAZARD RELEASE; COMPUTER SIMULATION; KINETICS; MAGNESIUM; THERMODYNAMICS;

EID: 84928499185 PISSN: 01928651 EISSN: 1096987X Source Type: Journal
DOI: 10.1002/jcc.23881 Document Type: Article

Times cited : (76)

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