José Ramón Mora

Orcid: 0000-0001-6128-9504

According to our database1, José Ramón Mora authored at least 8 papers between 2012 and 2024.

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

Timeline

Legend:

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PhD thesis 
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Links

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Bibliography

2024
Rethinking the applicability domain analysis in QSAR models.
J. Comput. Aided Mol. Des., December, 2024

Computational approaches for lead compound discovery in dipeptidyl peptidase-4 inhibition using machine learning and molecular dynamics techniques.
Comput. Biol. Chem., 2024

2023
ElectroPredictor: An Application to Predict Mayr's Electrophilicity <i>E</i> through Implementation of an Ensemble Model Based on Machine Learning Algorithms.
J. Chem. Inf. Model., January, 2023

Study of potential inhibition of the estrogen receptor α by cannabinoids using an <i>in silico</i> approach: Agonist vs antagonist mechanism.
Comput. Biol. Medicine, 2023

2022
Propagation and Parametric Amplification in Four-Wave Mixing Processes: Intramolecular Coupling and High-Order Effects.
Symmetry, 2022

2021
A computational study of the reaction mechanism involved in the fast cleavage of an unconstrained amide bond assisted by an amine intramolecular nucleophilic attack.
J. Comput. Chem., 2021

2012
The thermal decomposition of 4-bromobutyric acid in the gas phase: A quantum chemical theory calculation.
J. Comput. Methods Sci. Eng., 2012

DFT and ab-initio study on the mechanism of the gas-phase elimination kinetics of 1-chloro-3-methylbut-2-ene and 3-chloro-3-methylbut-1-ene and their isomerization.
J. Comput. Methods Sci. Eng., 2012


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