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Thermodynamics and Kinetics of Intramolecular Proton Transfer in Guanine. Post Hartree−Fock Study

✍ Scribed by Gorb, Leonid; Kaczmarek, Anna; Gorb, Anastasiya; Sadlej, Andrzej J.; Leszczynski, Jerzy


Book ID
115498257
Publisher
American Chemical Society
Year
2005
Tongue
English
Weight
81 KB
Volume
109
Category
Article
ISSN
0022-3654

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