Improving the study of proton transfers between amino acid...

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta) 2012 / 03 Vol. 131; Iss. 3

Improving the study of proton transfers between amino acid side chains in solution: choosing appropriate DFT functionals and avoiding hidden pitfalls

Pedro J. Silva, Marta A. S. Perez, Natércia F. Brás, Pedro A. Fernandes, M. J. Ramos
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Volume:
131
Language:
english
DOI:
10.1007/s00214-012-1179-x
Date:
March, 2012
File:
PDF, 218 KB
english, 2012
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