Synthesis and DFT Calculations of Novel Vanillin-Chalcones and Their 3-Aryl-5-(4-(2-(dimethylamino)-ethoxy)-3-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1 … LA Illicachi, JJ Montalvo-Acosta, A Insuasty, J Quiroga, R Abonia, ... Molecules 22 (9), 1476, 2017 | 46 | 2017 |
2D, 3D-QSAR and molecular docking of 4 (1H)-quinolones analogues with antimalarial activities TPJ Villalobos, RG Ibarra, JJM Acosta Journal of Molecular Graphics and Modelling 46, 105-124, 2013 | 30 | 2013 |
Correlation of membrane protein conformational and functional dynamics RR Sanganna Gari, JJ Montalvo‐Acosta, GR Heath, Y Jiang, X Gao, ... Nature Communications 12 (1), 4363, 2021 | 20 | 2021 |
Computational Approaches to the Chemical Equilibrium Constant in Protein‐ligand Binding JJ Montalvo‐Acosta, M Cecchini Molecular Informatics 35 (11-12), 555-567, 2016 | 17 | 2016 |
A linear interaction energy model for cavitand host–guest binding affinities JJ Montalvo-Acosta, P Pacak, DEB Gomes, M Cecchini The Journal of Physical Chemistry B 122 (26), 6810-6814, 2018 | 8 | 2018 |
Structure, substrate binding, and symmetry of the mitochondrial ADP/ATP carrier in its matrix-open state JJ Montalvo-Acosta, ERS Kunji, JJ Ruprecht, F Dehez, C Chipot Biophysical Journal 120 (23), 5187-5195, 2021 | 6 | 2021 |
A Supramolecular Model for the Co‐Catalytic Role of Nitro Compounds in Brønsted Acid Catalyzed Reactions JJ Montalvo‐Acosta, M Dryzhakov, E Richmond, M Cecchini, J Moran Chemistry–A European Journal 26 (48), 10976-10980, 2020 | 5 | 2020 |
Structure and linkage assessment of T-shaped Pyrrolidine [60] Fullerene-and Isoxazoline [60] Fullerene-BODIPY-triarylamine hybrids JS Rocha-Ortiz, JJ Montalvo-Acosta, Y He, A Insuasty, A Hirsch, ... Dyes and Pigments 217, 111445, 2023 | 4 | 2023 |
Quinoid compounds cause inhibition of falcipain 2, and arrest Plasmodium falciparum growth in vitro M Duran-Lengua, E Salas-Sarduy, LM Cano-Duran, E Carlos, ... Latin American Journal of Pharmacy 33 (4), 666-74, 2014 | 2 | 2014 |
D-QSAR analysis of neocryptolepine analogues with antimalarial activities JJ Montalvo-Acosta, RG Ibarra Journal of Drug Design and Research 2, 1017, 2 | 1 | 2 |
Computational approaches to molecular recognition: from host-guest to protein-ligand binding JJM Acosta Université de Strasbourg, 2018 | | 2018 |
Computational approaches to molecular recognition: from host-guest to protein-ligand binding JJM Acosta Strasbourg, 2018 | | 2018 |
Evaluación de las interacciones de análogos de neurotensina sobre el receptor Sortilin utilizando simulaciones Docking y dinámica molecular JJ Montalvo Acosta, J Villalobos Jiménez Universidad de Cartagena, 2011 | | 2011 |
Synthesis and Evaluation of New Isoquinoline Diimide Derivatives as Small Molecule Acceptors for Organic Solar Cells A Insuasty, S Carrara, D Vu, JJ Montalvo-Acosta, A Ortíz, CF Hogan, ... Available at SSRN 5056186, 0 | | |
DISEÑO RACIONAL DE INHIBIDORES DE PROTEASAS CON POTENCIAL APLICACIÓN ANTIMALÁRICA JJM Acosta, JV Jiménez, RG Ibarra | | |