Exportar referência
APA
Mohannad J. Yousef, Nuno F. B. Oliveira, João N. M. Vitorino, Pedro B. P. S. Reis, Piotr Draczkowski, Maciej Maj, Krzysztof Jozwiak, Miguel Machuqueiro, (2025). Toward Accurate pH-Dependent Binding Constant Predictions Using Molecular Docking and Constant-pH MD Calculations. Journal of Chemical Theory and Computation, 21, 2655-2667. ISSN 1549-9618. eISSN . https://doi.org/10.1021/acs.jctc.4c01291
IEEE
Mohannad J. Yousef, Nuno F. B. Oliveira, João N. M. Vitorino, Pedro B. P. S. Reis, Piotr Draczkowski, Maciej Maj, Krzysztof Jozwiak, Miguel Machuqueiro, "Toward Accurate pH-Dependent Binding Constant Predictions Using Molecular Docking and Constant-pH MD Calculations" in Journal of Chemical Theory and Computation, vol. 21, pp. 2655-2667, 2025.
10.1021/acs.jctc.4c01291
BIBTEX
@article{65124,
author = {Mohannad J. Yousef and Nuno F. B. Oliveira and João N. M. Vitorino and Pedro B. P. S. Reis and Piotr Draczkowski and Maciej Maj and Krzysztof Jozwiak and Miguel Machuqueiro},
title = {Toward Accurate pH-Dependent Binding Constant Predictions Using Molecular Docking and Constant-pH MD Calculations},
journal = {Journal of Chemical Theory and Computation},
year = 2025,
pages = {2655-2667},
volume = 21
}