Ibon Alkorta

According to our database, Ibon Alkorta authored at least 9 papers between 1993 and 2024.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2024

Discovering trends in the Lewis acidity of beryllium and magnesium hydrides and fluorides with increasing clusters size.

Otilia Mó, M. Merced Montero-Campillo, Manuel Yáñez, Ibon Alkorta, José Elguero

J. Comput. Chem., July, 2024

2023

Dismantlement of ammonia upon interaction with Be_<i>n</i> (<i>n</i> ≤ 10) clusters.

Manuel Yáñez, Filiberto Ortíz-Chi, Gabriel Merino, Ibon Alkorta

J. Comput. Chem., January, 2023

2018

An interacting quantum atom study of model SN2 reactions (X-···CH3X, X = F, Cl, Br, and I).

Ibon Alkorta, Joseph C. R. Thacker, Paul L. A. Popelier

J. Comput. Chem., 2018

2010

Prediction of the Basicities of Pyridines in the Gas Phase and in Aqueous Solution.

Glenn I. Hawe, Ibon Alkorta, Paul L. A. Popelier

J. Chem. Inf. Model., 2010

2003

Comparison of electron density properties in frozen and relaxed electronic distributions.

Ibon Alkorta, José Elguero, Enrique Espinosa, Ignasi Mata, Elies Molins

J. Comput. Chem., 2003

1993

Comparison of methods to estimate the free energy of solvation: Importance in the modulation of the affinity of 3-benzazepines for the D₁receptor.

Ibon Alkorta, Hugo O. Villar, Juan Jesús Pérez

J. Comput. Chem., 1993

Conformational analysis of 2, 3, 6, 7-tetrahydroazepines with implications for D₁-selective benzazepines.

Ibon Alkorta, Hugo O. Villar, Raul E. Cachau

J. Comput. Chem., 1993

Comparative study between <i>ab initio</i> and semiempirical electrostatic potentials on molecular surfaces.

Ibon Alkorta, Hugo O. Villar, Gustavo A. Arteca

J. Comput. Chem., 1993

Considerations on the recognition of the D1 receptor by agonists.

Ibon Alkorta, Hugo O. Villar

J. Comput. Aided Mol. Des., 1993