Using the isotropic periodic sum method to calculate long-range interactions of heterogeneous systems

Journal of Chemical Physics

Volumn 129, Issue 15, 2008, Pages

  Wu, Xiongwu ^a   Brooks, Bernard R ^a  

^a NATIONAL HEART LUNG AND BLOOD INSTITUTE   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SYSTEMS; FAST FOURIER TRANSFORMS; FOURIER TRANSFORMS; MOLECULAR STRUCTURE; SWITCHING SYSTEMS; THREE DIMENSIONAL; UNINTERRUPTIBLE POWER SYSTEMS; VAN DER WAALS FORCES;

CUTOFF DISTANCES; DISCRETE FAST FOURIER TRANSFORMS; ELECTROSTATIC; FINITE SYSTEMS; HETEROGENEOUS; HETEROGENEOUS SYSTEMS; HOMOGENEOUS SYSTEMS; IPS METHODS; ISOTROPIC PERIODIC SUM METHODS; LOCAL REGIONS; LONG-RANGE; LONG-RANGE INTERACTIONS; MOLECULAR SIMULATIONS; PERIODIC; PERIODIC SYSTEMS; SIMULATION SYSTEMS; VAN DER WAALS INTERACTIONS;

FLOW INTERACTIONS;

CARRIER PROTEIN; SODIUM; WATER;

ALGORITHM; ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; FOURIER ANALYSIS; PROTEIN CONFORMATION; SENSITIVITY AND SPECIFICITY; SURFACE TENSION; VACUUM;

ALGORITHMS; CARRIER PROTEINS; FOURIER ANALYSIS; MODELS, CHEMICAL; MODELS, MOLECULAR; PROTEIN CONFORMATION; SENSITIVITY AND SPECIFICITY; SODIUM; SURFACE TENSION; VACUUM; WATER;

EID: 54849427314     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2992601     Document Type: Article

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