Jerônimo Lameira

Publication Activity (10 Years)

Years Active: 2012-2023
Publications (10 Years): 8

Top Topics

Quantum Mechanics

Top Venues

J. Chem. Inf. Model.

Comput. Biol. Medicine

Comput. Biol. Chem.

Publications

Luan Carvalho Martins, Renata Barbosa de Oliveira, Jerônimo Lameira, Rafaela Salgado Ferreira
Experimental and Computational Study of Aryl-thiosemicarbazones Inhibiting Cruzain Reveals Reversible Inhibition and a Stepwise Mechanism. J. Chem. Inf. Model. 63 (5) (2023)
Alberto M. dos Santos, Amanda Ruslana Santana Oliveira, Clauber Henrique Costa, Peter W. Kenny, Carlos A. Montanari, Jaldyr de Jesus G. Varela, Jerônimo Lameira
Assessment of Reversibility for Covalent Cysteine Protease Inhibitors Using Quantum Mechanics/Molecular Mechanics Free Energy Surfaces. J. Chem. Inf. Model. 62 (17) (2022)
Vinícius Bonatto, Anwar Shamim, Fernanda dos R. Rocho, Andrei Leitão, F. Javier Luque, Jerônimo Lameira, Carlos A. Montanari
Predicting the Relative Binding Affinity for Reversible Covalent Inhibitors by Free Energy Perturbation Calculations. J. Chem. Inf. Model. 61 (9) (2021)
Paulo R. M. Pereira, Jéssica de O. Araújo, José Rogério A. Silva, Cláudio Nahum Alves, Jerônimo Lameira, Anderson Henrique Lima e Lima
Exploring Chloride Selectivity and Halogenase Regioselectivity of the SalL Enzyme through Quantum Mechanical/Molecular Mechanical Modeling. J. Chem. Inf. Model. 60 (2) (2020)
José Rogério A. Silva, Lorenzo Cianni, Deborah Araujo, Pedro Henrique Jatai Batista, Daniela de Vita, Fabiana Rosini, Andrei Leitão, Jerônimo Lameira, Carlos A. Montanari
Assessment of the Cruzain Cysteine Protease Reversible and Irreversible Covalent Inhibition Mechanism. J. Chem. Inf. Model. 60 (3) (2020)
Clauber Henrique Costa, Vinícius Bonatto, Alberto M. dos Santos, Jerônimo Lameira, Andrei Leitão, Carlos A. Montanari
Evaluating QM/MM Free Energy Surfaces for Ranking Cysteine Protease Covalent Inhibitors. J. Chem. Inf. Model. 60 (2) (2020)
João Marcos Galúcio, Elton Figueira Monteiro, Deivid Almeida de Jesus, Clauber Henrique Costa, Raissa Caroline Siqueira, Gabriela Bianchi dos Santos, Jerônimo Lameira, Kauê Santana da Costa
identification of natural products with anticancer activity using a chemo-structural database of Brazilian biodiversity. Comput. Biol. Chem. 83 (2019)
Elnaz Aledavood, Gleiciane Moraes, Jerônimo Lameira, Ana Castro, F. Javier Luque, Carolina Estarellas
Understanding the Mechanism of Direct Activation of AMP-Kinase: Toward a Fine Allosteric Tuning of the Kinase Activity. J. Chem. Inf. Model. 59 (6) (2019)
Ronaldo Correia da Silva, Nelson Alberto N. de Alencar, Cláudio Nahum Alves, Jerônimo Lameira
Analysis of the structure of calpain-10 and its interaction with the protease inhibitor SNJ-1715. Comput. Biol. Medicine 43 (10) (2013)
Luis Guimarães, Natália F. Silva, Anderson Miyoshi, Maria P. C. Schneider, Artur Silva, Vasco Azevedo, Davi S. B. Brasil, Jerônimo Lameira, Cláudio Nahum Alves
Structure modeling of a metalloendopeptidase from Corynebacterium pseudotuberculosis. Comput. Biol. Medicine 42 (5) (2012)
Nelson Alberto N. de Alencar, Paulo Robson M. Sousa, José Rogério A. Silva, Jerônimo Lameira, Cláudio Nahum Alves, Sergio Martí, Vicent Moliner
Computational Analysis of Human OGA Structure in Complex with PUGNAc and NAG-Thiazoline Derivatives. J. Chem. Inf. Model. 52 (10) (2012)