Motion of an antiviral compound in a rhinovirus capsid under rotational symmetry boundary conditions

Journal of Molecular Graphics and Modelling

Volumn 21, Issue 1, 2002, Pages 19-27

  Yoneda, Shigetaka ^a   Yoneda, Teruyo ^a   Kurihara, Youji ^a   Umeyama, Hideaki ^a  

^a KITASATO UNIVERSITY   (Japan)

Author keywords

Common cold; Molecular dynamics simulation; Picornavirus; Uncoating; WIN52084s

Indexed keywords

ELECTROSTATIC POTENTIAL;

BOUNDARY CONDITIONS; COMPUTER SIMULATION; CONFORMATIONS; DRUG PRODUCTS; MOLECULAR DYNAMICS; PROTEINS; TRAJECTORIES;

MOLECULAR GRAPHICS;

3 METHYL 5 [7 [4 (4 METHYL 2 OXAZOLIN 2 YL)PHENOXY]HEPTYL]ISOXAZOLE; VIRUS PROTEIN;

ARTICLE; ATOM; CALCULATION; CONTROLLED STUDY; DRUG STRUCTURE; ELECTRICITY; MOLECULAR DYNAMICS; NONHUMAN; PRIORITY JOURNAL; PROTEIN CONFORMATION; RHINOVIRUS; SIMULATION; STRUCTURE ANALYSIS; VIRUS CAPSID; X RAY;

ANTIVIRAL AGENTS; CAPSID; COMPUTER SIMULATION; ISOXAZOLES; MODELS, MOLECULAR; RHINOVIRUS; WATER;

PICORNAVIRIDAE; RHINOVIRUS;

EID: 0036277798     PISSN: 10933263     EISSN: None     Source Type: Journal    
DOI: 10.1016/S1093-3263(02)00105-5     Document Type: Article

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