| Binding Analysis of Some Classical Acetylcholinesterase Inhibitors: Insights for a Rational Design Using Free Energy Perturbation Method Calculations with QM/MM MD Simulations JA Érica C. M. Nascimento, Mónica Oliva, Katarzyna Świderek, João B. L. Martins J. Chem. Inf. Model., 2017 | 32* | 2017 |
| Theoretical study of classical acetylcholinesterase inhibitors ÉCM Nascimento, JBL Martins, ML dos Santos, R Gargano Chemical Physics Letters 458 (4-6), 285-289, 2008 | 27 | 2008 |
| Electronic structure and PCA analysis of covalent and non-covalent acetylcholinesterase inhibitors ÉCM Nascimento, JBL Martins Journal of Molecular Modeling 17, 1371-1379, 2011 | 24 | 2011 |
| Saberes docentes interdisciplinares construídos na prática pedagógica E Nascimento, S Braz, M Castro Congresso internacional interdisciplinar em sociais e humanidades, 1-17, 2012 | 14 | 2012 |
| A binuclear copper (II) complex based on hydrazone ligand: Characterization, molecular docking, and theoretical and antimicrobial investigation PHO Santiago, EA Duarte, ÉCM Nascimento, JBL Martins, MS Castro, ... Applied Organometallic Chemistry 36 (1), e6461, 2022 | 7 | 2022 |
| Ab-initio study of spin-orbit effect on 175Lu19F spectroscopy J Assaf, S Zeitoun, A Safa, ECM Nascimento Journal of Molecular Structure 1178, 458-466, 2019 | 7 | 2019 |
| CM; Oliva, M.; Świderek, K.; Martins, JBL; Andrés, J É Nascimento Binding analysis of some classical acetylcholinesterase inhibitors: insights …, 2017 | 7 | 2017 |
| Pharmacophoric Profile: Design of New Potential Drugs with PCA Analysis ÉCM Nascimento, JBL Martins Edited by Parinya Sanguansat, 59, 2012 | 7 | 2012 |
| CM; Martins, JBL; dos Santos, ML; Gargano, R. Theoretical study of classical acetylcholinesterase inhibitors É Nascimento Chem. Phys. Lett 458 (4-6), 285-289, 2008 | 7 | 2008 |
| Microscale Determination of Vitamin C by Weight Titrimetry ECN Gaston A. East Journal of chemical education 79 (1), 100, 2002 | 7 | 2002 |
| Organometallic gold (III) and platinum (II) complexes with thiosemicarbazone: Structural behavior, anticancer activity, and molecular docking CM Almeida, PH S. Marcon, ÉCM Nascimento, JBL Martins, MAS Chagas, ... Applied Organometallic Chemistry 36 (8), e6761, 2022 | 6 | 2022 |
| In silico study of tacrine and acetylcholine binding profile with human acetylcholinesterase: docking and electronic structure LA Nascimento, ÉCM Nascimento, JBL Martins Journal of Molecular Modeling 28 (9), 252, 2022 | 5 | 2022 |
| Electronic and structural study of T315I mutated form in DFG-out conformation of BCR-ABL inhibitors WA Pereira, ÉCM Nascimento, JBL Martins Journal of Biomolecular Structure and Dynamics 40 (20), 9774-9788, 2022 | 4 | 2022 |
| Investigation on the interaction behavior of afatinib, dasatinib, and imatinib docked to the BCR-ABL protein KML Rocha, ÉCM Nascimento, JBL Martins Journal of molecular modeling 27, 1-12, 2021 | 4 | 2021 |
| Theoretical study of LuH molecule: Potential energy curves, spectroscopic constants and spin-orbit couplings J Assaf, FEH Hassan, ÉCM Nascimento, A Haydar Computational and Theoretical Chemistry 1128, 31-41, 2018 | 4 | 2018 |
| Determinação teórica de propriedades relevantes para a atividade de inibidor da acetilcolinesterase ÉCM Nascimento | 4 | 2009 |
| Binding free energy calculations to rationalize the interactions of huprines with acetylcholinesterase ÉCM Nascimento, M Oliva, J Andrés Journal of Computer-Aided Molecular Design, 1-16, 2018 | 2 | 2018 |
| Dithiocarbazate ligands and their Ni (II) complexes with potential biological activity: Structural, antitumor and molecular docking study CQO Cavalcante, THA da Mota, DM de Oliveira, ÉCM Nascimento, ... Frontiers in Molecular Biosciences 10, 1146820, 2023 | 1 | 2023 |
| New insight into the spectroscopy of LaH by ab-initio methods J Assaf, R Assaf, ECM Nascimento Computational and Theoretical Chemistry 1203, 113363, 2021 | 1 | 2021 |
| Desenhos de Novos Compostos com Potencial Atividade Biológica R Gargano, AAN Paula, LAS Romeiro, ÉCM Nascimento, AS Kiametis, ... Revista Processos Químicos 5 (10), 9-24, 2011 | 1 | 2011 |
