Theoretical Study on the Excited States of Psoralen Compounds Bonded to a Thymine Residue

Journal of Computational Chemistry

Volumn 25, Issue 2, 2004, Pages 179-188

  Nakata, A ^a   Baba, T ^a   Takahashi, H ^a   Nakai, H ^a  

^a WASEDA UNIVERSITY   (Japan)

Author keywords

Density functional theory calculations; Psoralen compounds; Thymine residue

Indexed keywords

ABSORPTION SPECTROSCOPY; CHEMICAL BONDS; CHEMOTHERAPY; ELECTRONIC STRUCTURE; ENERGY GAP; FURAN RESINS; GROUND STATE; PROBABILITY DENSITY FUNCTION; ULTRAVIOLET SPECTROSCOPY;

EXCITATION ENERGY; TIME DEPENDENT DENSITY FUNCTIONAL THEORY (TDDFT);

DRUG PRODUCTS;

INTERCALATING AGENT; METHOXSALEN; PSORALEN DERIVATIVE; THYMINE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; KINETICS;

INTERCALATING AGENTS; KINETICS; METHOXSALEN; MODELS, MOLECULAR; MOLECULAR CONFORMATION; PSORALENS; THYMINE;

EID: 0348232115     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/jcc.10380     Document Type: Article

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