Jerônimo Lameira

Orcid: 0000-0001-7270-1517

According to our database1, Jerônimo Lameira authored at least 11 papers between 2012 and 2023.

Collaborative distances:
  • Dijkstra number2 of five.
  • Erdős number3 of five.

Timeline

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Bibliography

2023
Experimental and Computational Study of Aryl-thiosemicarbazones Inhibiting Cruzain Reveals Reversible Inhibition and a Stepwise Mechanism.
J. Chem. Inf. Model., March, 2023

2022
Assessment of Reversibility for Covalent Cysteine Protease Inhibitors Using Quantum Mechanics/Molecular Mechanics Free Energy Surfaces.
J. Chem. Inf. Model., 2022

2021
Predicting the Relative Binding Affinity for Reversible Covalent Inhibitors by Free Energy Perturbation Calculations.
J. Chem. Inf. Model., 2021

2020
Assessment of the Cruzain Cysteine Protease Reversible and Irreversible Covalent Inhibition Mechanism.
J. Chem. Inf. Model., 2020

Exploring Chloride Selectivity and Halogenase Regioselectivity of the SalL Enzyme through Quantum Mechanical/Molecular Mechanical Modeling.
J. Chem. Inf. Model., 2020

Evaluating QM/MM Free Energy Surfaces for Ranking Cysteine Protease Covalent Inhibitors.
J. Chem. Inf. Model., 2020

2019
Understanding the Mechanism of Direct Activation of AMP-Kinase: Toward a Fine Allosteric Tuning of the Kinase Activity.
J. Chem. Inf. Model., 2019

<i>In silico</i> identification of natural products with anticancer activity using a chemo-structural database of Brazilian biodiversity.
Comput. Biol. Chem., 2019

2013
Analysis of the structure of calpain-10 and its interaction with the protease inhibitor SNJ-1715.
Comput. Biol. Medicine, 2013

2012
Computational Analysis of Human OGA Structure in Complex with PUGNAc and NAG-Thiazoline Derivatives.
J. Chem. Inf. Model., 2012

Structure modeling of a metalloendopeptidase from Corynebacterium pseudotuberculosis.
Comput. Biol. Medicine, 2012


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