Investigation on an Orientation and Interaction Energy of the Water Molecule in the HIV-1 Reverse Transcriptase Active Site by Quantum Chemical Calculations

Journal of Chemical Information and Computer Sciences

Volumn 43, Issue 5, 2003, Pages 1584-1590

  Kuno, Mayuso ^a   Palangsuntikul, Rungtiva ^a   Hannongbua, Supa ^a  

^a KASETSART UNIVERSITY   (Thailand)

Author keywords

[No Author keywords available]

Indexed keywords

BIOACTIVE SITES;

AMINO ACIDS; BINDING ENERGY; CATALYSIS; CONFORMATIONS; ENZYME KINETICS; HYDROGEN BONDS; MOLECULAR DYNAMICS; MOLECULAR ORIENTATION; QUANTUM THEORY; WATER ANALYSIS;

BIOCHEMISTRY;

AMINO ACID; RNA DIRECTED DNA POLYMERASE; WATER;

ARTICLE; BINDING SITE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; HUMAN; HYDROGEN BOND; METABOLISM; PROTEIN CONFORMATION; QUANTUM THEORY; THERMODYNAMICS;

AMINO ACIDS; BINDING SITES; HIV-1 REVERSE TRANSCRIPTASE; HUMANS; HYDROGEN BONDING; MODELS, CHEMICAL; MODELS, MOLECULAR; PROTEIN CONFORMATION; QUANTUM THEORY; THERMODYNAMICS; WATER;

EID: 0141890719     PISSN: 00952338     EISSN: None     Source Type: Journal    
DOI: 10.1021/ci0203850     Document Type: Article

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