Fisher information and steric effect: Study of the internal rotation barrier of ethane RO Esquivel, S Liu, JC Angulo, JS Dehesa, J Antolín, M Molina-Espíritu The Journal of Physical Chemistry A 115 (17), 4406-4415, 2011 | 77 | 2011 |
Quantum entanglement and the dissociation process of diatomic molecules RO Esquivel, N Flores-Gallegos, M Molina-Espíritu, AR Plastino, ... Journal of Physics B: Atomic, Molecular and Optical Physics 44 (17), 175101, 2011 | 36 | 2011 |
Concurrent phenomena at the transition region of selected elementary chemical reactions: An information‐theoretical complexity analysis RO Esquivel, M Molina‐Espíritu, JS Dehesa, JC Angulo, J Antolín International Journal of Quantum Chemistry 112 (22), 3578-3586, 2012 | 26 | 2012 |
Information-theoretical complexity for the hydrogenic abstraction reaction RO Esquivel, M Molina-Espíritu, JC Angulo, J Antolín, N Flores-Gallegos, ... Molecular Physics 109 (19), 2353-2365, 2011 | 24 | 2011 |
Information-theoretic space from simple atomic and molecular systems to biological and pharmacological molecules RO Esquivel, S López-Rosa, M Molina-Espíritu, JC Angulo, JS Dehesa Theoretical Chemistry Accounts 135, 1-6, 2016 | 21 | 2016 |
Quantum entanglement and chemical reactivity M Molina-Espíritu, RO Esquivel, S López-Rosa, JS Dehesa Journal of Chemical Theory and Computation 11 (11), 5144-5151, 2015 | 21 | 2015 |
Decoding the building blocks of life from the perspective of quantum information RO Esquivel, M Molina-Espíritu, F Salas, C Soriano, C Barrientos, ... Advances in Quantum Mechanics, 2013 | 21 | 2013 |
Information-theoretical complexity for the hydrogenic identity S N 2 exchange reaction M Molina-Espíritu, RO Esquivel, JC Angulo, J Antolín, JS Dehesa Journal of Mathematical Chemistry 50, 1882-1900, 2012 | 19 | 2012 |
Predominant Information Quality Scheme for the Essential Amino Acids: An Information‐Theoretical Analysis RO Esquivel, M Molina‐Espíritu, S López‐Rosa, C Soriano‐Correa, ... ChemPhysChem 16 (12), 2571-2581, 2015 | 16 | 2015 |
Recent advances toward the nascent science of quantum information chemistry RO Esquivel, JC Angulo, JS Dehesa, J Antolín, S López-Rosa, ... Information Theory: New Research, 297-334, 2012 | 14 | 2012 |
Quantum information from selected elementary chemical reactions: Maximum entangled transition state RO Esquivel, M Molina‐Espíritu, AR Plastino, JS Dehesa International Journal of Quantum Chemistry 115 (19), 1417-1430, 2015 | 10 | 2015 |
Concurrent Phenomena at the Reaction Path of the SN2 Reaction CH3Cl + F−. Information Planes and Statistical Complexity Analysis M Molina-Espíritu, RO Esquivel, JC Angulo, JS Dehesa Entropy 15 (10), 4084-4104, 2013 | 10 | 2013 |
Study of the chemical space of selected bacteriostatic sulfonamides from an information theory point of view S López‐Rosa, M Molina‐Espíritu, RO Esquivel, C Soriano‐Correa, ... ChemPhysChem 17 (23), 4003-4010, 2016 | 8 | 2016 |
Information‐theoretical analysis for the SN2 exchange reaction CH3Cl + F− M Molina‐Espíritu, RO Esquivel, JC Angulo, J Antolin, C Iuga, JS Dehesa International Journal of Quantum Chemistry 113 (24), 2589-2599, 2013 | 8 | 2013 |
Insight into the informational-structure behavior of the Diels-Alder reaction of cyclopentadiene and maleic anhydride M Molina-Espíritu, RO Esquivel, M Kohout, JC Angulo, JA Dobado, ... Journal of molecular modeling 20, 1-13, 2014 | 6 | 2014 |
3D Information-Theoretic Analysis of the Simplest Hydrogen Abstraction Reaction RO Esquivel, M Molina-Espíritu, S López-Rosa The Journal of Physical Chemistry A 127 (30), 6159-6174, 2023 | 5 | 2023 |
Information-theoretic representation of the chemical space of many electron systems RO Esquivel, S López-Rosa, M Molina-Espíritu, C Soriano-Correa, ... Front. Comput. Chem. 3, 3-46, 2016 | 2 | 2016 |
Information-Theoretical Complexity Analysis of Selected Elementary Chemical Reactions M Molina-Espíritu, RO Esquivel, JS Dehesa Without Bounds: A Scientific Canvas of Nonlinearity and Complex Dynamics …, 2013 | 2 | 2013 |
Quantum information-theoretical analyses of systems and processes of chemical and nanotechnological interest RO Esquivel, EM Carrera, C Iuga, M Molina-Espíritu, JC Angulo, ... Some Applications of Quantum Mechanics, 2012 | 1 | 2012 |
3D information-theoretic analysis of the simplest hydrogen abstraction reaction RO Esquivel Olea, M Molina Espíritu, S López Rosa The Journal of Physical Chemistry A, 127 (30), 6159-6174., 2023 | | 2023 |