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Prediction of Tautomeric Equilibria: QSAR vs Quantum Chemistry
Prediction of Tautomeric Equilibria: QSAR vs Quantum Chemistry
2016
Timur I. Madzhidov
Timur Gimadiev
R. I. Nugmanov
I. I. Baskin
I. S. Antipin
A. Varnek
Keywords:
Tautomer
Physical chemistry
Quantum chemistry
Quantitative structure–activity relationship
Chemistry
Computational chemistry
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