Rodrigo D. Tosso

Molecular Modeling Study of Dihydrofolate Reductase Inhibitors. Molecular Dynamics Simulations, Quantum Mechanical Calculations, and Experimental Corroboration

Rodrigo D. Tosso, Sebastián A. Andújar, Lucas Gutiérrez et al. · Journal of Chemical Information and Modeling · 2013 · 62 citations

Energetic Viewpoints, Engineering, Computational Chemistry +18

Searching the “Biologically Relevant”Conformation of Dopamine: A Computational Approach

Sebastián A. Andújar, Rodrigo D. Tosso, Fernando D. Suvire et al. · Journal of Chemical Information and Modeling · 2011 · 51 citations

Combined MD/QTAIM techniques to evaluate ligand-receptor interactions. Scope and limitations

Sebastián Martínez Rojas, Oscar Parravicini, Marcela Vettorazzi et al. · European Journal of Medicinal Chemistry · 2020 · 34 citations · Full text

Molecular Pharmacology, Md/qtaim Techniques, Drug Target +8

Non-covalent interactions in receptor-ligand complexes. A study based on the electron charge density

Emilio Angelina, Sebastián A. Andújar, Rodrigo D. Tosso et al. · Journal of Physical Organic Chemistry · 2013 · 32 citations · Full text

Molecular insight into the interaction mechanisms of amino-2<i>H</i>-imidazole derivatives with BACE1 protease: A QM/MM and QTAIM study

Esteban G. Vega‐Hissi, Rodrigo D. Tosso, Ricardo D. Enriz et al. · International Journal of Quantum Chemistry · 2014 · 24 citations · Full text