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Hydrogen-bonded proton transfer in the hydrated adenine–thymine anion

✍ Scribed by Wu, Yingxi; Wang, Hongyan; Lin, Yuexia; Gao, Simin; Zhang, Feng

Book ID
120500673
Publisher
NRC Research Press
Year
2013
Tongue
French
Weight
825 KB
Volume
91
Category
Article
ISSN
0008-4042

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Electron correlated and density functional studies on hydrogen-bonded proton transfer in adenine–thymine base pair of DNA
✍ Naoto Shimizu; Satoyuki Kawano; Masanori Tachikawa 📂 Article 📅 2005 🏛 Elsevier Science 🌐 English ⚖ 498 KB

The potential energy surface along the hydrogen-bonded proton transfer between the Watson-Crick (WC) adenine-thymine (A-T) base pair of deoxyribonucleic acid (DNA) and its tautomeric structures is calculated with 6-31G(d,p) basis set in Hartree-Fock (HF), density functional theory with Becke's three