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Reactivity of bisphenol A-3,4-quinone with DNA. A quantum chemical study

✍ Scribed by Katra Kolšek; Janez Mavri; Marija Sollner Dolenc

Book ID
116920551
Publisher
Elsevier Science
Year
2012
Tongue
English
Weight
385 KB
Volume
26
Category
Article
ISSN
0887-2333

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✍ Ahmed Mehdi; Legesse Adane; Dhilon S. Patel; Prasad V. Bharatam 📂 Article 📅 2009 🏛 John Wiley and Sons 🌐 English ⚖ 685 KB

## Abstract Electronic structure analysis of guanylthiourea (GTU) and its isomers has been carried out using quantum chemical methods. Two major tautomeric classes (thione and thiol) have been identified on the potential energy (PE) surface. In both the cases conjugation of pi‐electrons and intramo