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Journal Articles
- 2025
[j5]Ayelén Schiel
, Rodrigo D. Tosso, Emilio Angelina, Ainhoa García, Nathalie Hennuyer, Diego Cortes, Nuria Cabedo, Ricardo D. Enriz:
N-Tosyl Hydrazone Benzopyran, a New Ligand of PPARα Obtained from Mapping the Conformational Space of Its Active Site. J. Chem. Inf. Model. 65(1): 298-311 (2025)- 2022
- [j4]Rodrigo D. Tosso, M. Natalia C. Zarycz, Ayelén Schiel, Luisa Goicoechea Moro, Héctor A. Baldoni, Emilio Angelina, Ricardo D. Enriz:
Evaluating the conformational space of the active site of D2 dopamine receptor. Scope and limitations of the standard docking methods. J. Comput. Chem. 43(19): 1298-1312 (2022) - 2020
- [j3]Rodrigo D. Tosso, Oscar Parravicini, M. Natalia C. Zarycz, Emilio Angelina, Marcela Vettorazzi, Nelida Peruchena, Sebastian A. Andujar, Ricardo D. Enriz:
Conformational and electronic study of dopamine interacting with the D2 dopamine receptor. J. Comput. Chem. 41(21): 1898-1911 (2020) - 2013
- [j2]Rodrigo D. Tosso, Sebastian A. Andujar, Lucas Gutierrez, Emilio Angelina, Ricaurte Rodríguez, Manuel Nogueras, Héctor A. Baldoni, Fernando D. Suvire, Justo Cobo, Ricardo D. Enriz:
Molecular Modeling Study of Dihydrofolate Reductase Inhibitors. Molecular Dynamics Simulations, Quantum Mechanical Calculations, and Experimental Corroboration. J. Chem. Inf. Model. 53(8): 2018-2032 (2013) - 2012
- [j1]Sebastian A. Andujar, Rodrigo D. Tosso, Fernando D. Suvire, Emilio Angelina, Nelida Peruchena, Nuria Cabedo, Diego Cortes, Ricardo D. Enriz:
Searching the "Biologically Relevant"Conformation of Dopamine: A Computational Approach. J. Chem. Inf. Model. 52(1): 99-112 (2012)
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