J. Raúl Alvarez-Idaboy

Orcid: 0000-0002-2901-5412

According to our database1, J. Raúl Alvarez-Idaboy authored at least 12 papers between 1998 and 2022.

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

Timeline

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Bibliography

2022
Chemical repair of damaged leucine and tryptophane by thiophenols at close to diffusion-controlled rates: Mechanisms and kinetics.
J. Comput. Chem., 2022

2019
Thiophenols, Promising Scavengers of Peroxyl Radicals: Mechanisms and kinetics.
J. Comput. Chem., 2019

2016
Coumarin-Chalcone Hybrids as Peroxyl Radical Scavengers: Kinetics and Mechanisms.
J. Chem. Inf. Model., 2016

Empirically Fitted Parameters for Calculating p<i>K</i><sub>a</sub> Values with Small Deviations from Experiments Using a Simple Computational Strategy.
J. Chem. Inf. Model., 2016

2015
Assessing the Protective Activity of a Recently Discovered Phenolic Compound against Oxidative Stress Using Computational Chemistry.
J. Chem. Inf. Model., 2015

2014
Lipoic Acid and Dihydrolipoic Acid. A Comprehensive Theoretical Study of Their Antioxidant Activity Supported by Available Experimental Kinetic Data.
J. Chem. Inf. Model., 2014

Kinetics of radical-molecule reactions in aqueous solution: A benchmark study of the performance of density functional methods.
J. Comput. Chem., 2014

2013
A computational methodology for accurate predictions of rate constants in solution: Application to the assessment of primary antioxidant activity.
J. Comput. Chem., 2013

2006
A new approach to counterpoise correction to BSSE.
J. Comput. Chem., 2006

2001
OH hydrogen abstraction reactions from alanine and glycine: A quantum mechanical approach.
J. Comput. Chem., 2001

1999
Ab-initio study of initial atmospheric oxidation reactions of C3 and C4 alkanes.
J. Comput. Chem., 1999

1998
Energetics of mechanism of OH-propene reaction at low pressures in inert atmosphere.
J. Comput. Chem., 1998


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