Structural analysis and the effect of cyclo(His-Pro) dipeptide on neurotoxins-a dynamics and density functional theory study

Journal of Molecular Modeling

Volumn 16, Issue 2, 2010, Pages 193-202

  Abiram, Angamuthu ^a   Kolandaivel, Ponmalai ^a  

^a BHARATHIAR UNIVERSITY   (India)

Author keywords

Cyclic dipeptides; Density functional theory; Glutamate; Molecular dynamics; Molecular electrostatic potential; Paraquat

Indexed keywords

CYCLO(HISTIDYLPROLINE); GLUTAMIC ACID; HYDROGEN; IMIDAZOLE; NEUROTOXIN; PARAQUAT; PIPERAZINEDIONE;

ARTICLE; CELL DEATH; CHEMICAL INTERACTION; CONTROLLED STUDY; DENSITY FUNCTIONAL THEORY; ELECTRIC POTENTIAL; HYDROGEN BOND; MATHEMATICAL ANALYSIS; MOLECULAR DYNAMICS; OXIDATIVE STRESS; PRIORITY JOURNAL; PROBABILITY; PROTEIN CONFORMATION; PROTEIN STRUCTURE; QUANTUM CHEMISTRY; VIBRATION;

GLUTAMIC ACID; HYDROGEN BONDING; MODELS, MOLECULAR; MODELS, THEORETICAL; MOLECULAR DYNAMICS SIMULATION; MOLECULAR STRUCTURE; NEUROTOXINS; PARAQUAT; PEPTIDES, CYCLIC; PIPERAZINES;

CHANDIPURA VIRUS;

EID: 75949109860     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-009-0531-0     Document Type: Article

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