- Theoretical Study of Structural and Electronic Trends of the Sulfonylurea Herbicides Family. Antonio Pulgar, Mónica Valentín, Clemens Rauer, Paula Pla, José Luis Alonso-Prados, Pilar Sandín-España, Al Mokhtar Lamsabhi, Manuel Alcamí. Journal of Physical Chemistry A, 128, 29 (2024)
- Stereoisomeric separation of the chiral herbicide profoxydim and residue method development in rice by QuEChERS and LC–MS/MS. Álvaro Cervantes-Díaz, Miguelina M. Mateo-Miranda, Nohemí H. Torrado-Cubero, José Luis Alonso-Prados, Pilar Sandín-España. Food Chemistry, 443, 138536 (2024)
- Ionization, intrinsic basicity, and intrinsic acidity of unsaturated diols of astrochemical interest: 1,1- and 1,2-ethenediol: A theoretical survey. Otilia Mó, Al Mokhtarb Lamsabhi, Jean-Claude Guillemin, Manuel Yáñez. Journal of Computational Chemistry, 45, 140-149 (2024)
- Mechanistic insights into chloramphenicol-mediated inactivation of cytochrome P450 enzymes and their active site mutants. Emadeldin M Kamel, Ahmed M Tawfeek, Ashraf A El-Bassuony, Al Mokhtar Lamsabhi. New Journal of Chemistry, 47, 35 (2023)
- Mechanistic aspects of reactive metabolite formation in clomethiazole catalyzed biotransformation by cytochrome P450 enzymes. Emadeldin M Kamel, Ahmed M Tawfeek, Ashraf A El-Bassuony, Al Mokhtar Lamsabhi. Organic & Biomolecular Chemistry, 21, 35 (2023)
- Assesing the effect of organic amendments on the degradation of profoxydim in paddy soils: Kinetic modeling and identification of degradation products. Álvaro Cervantes-Díaz, Elena Alonso-Prados, José Luis Alonso-Prados, Pilar Sandín-España. Science of the Total Environment, 20, 912 (2023)
- Reactivity of alloxydim herbicide: force and reaction electronic flux profiles. Juan José Villaverde, Pilar Sandín-España, José Luis Alonso-Prados, Manuel Alcamí, Al Mokhtarb Lamsabhi. Theorical Chemistry Accounts, 10, 142 (2023)
- A Theoretical Survey of the UV–Visible Spectra of Axially and Peripherally Substituted Boron Subphthalocyanines. Al Mokhtar Lamsabhi, M. Merced Montero-Campillo, Otilia Mó, Manuel Yáñez. Computation, 10, 14 (2022)
- Open questions on toxic heavy metals Cd, Hg and Pb binding small components of DNA and nucleobases. Are there any predictable trend? Álvaro Pérez-Barcia, M. Merced Montero-Campillo, Al Mokhtar Lamsabhi, Jean-Yves Salpin, Manuel Yáñez. Phys. Chem. Chem. Phys., 24 (35), 20624 – 20637 (2022)
- Aportación de la química computacional a la evaluación de riesgo de los plaguicidas bajo el Reglamento (CE) Nº 1107/2009: Aloxidim como caso de estudio. Juan José Villaverde, Beatriz Sevilla Morán, José Luis Alonso Prados, Pilar Sandín-España. Anales de Química de la RSEQ. 118 (1), 41-45 (2022).
- Impact of drinking water treatment processes on the residues of plant protection products for consumer and aquatic risk assessment: theoretical and experimental studies. Angela Mari, Elena Alonso-Prados, Juan José Villaverde, Jose Luis Alonso-Prados, Pilar Sandín-España. EFSA Journal, 20 (S2), Special Issue EU-FORA Series 5 (2022). (Q2, IF = 3.480 – 2021)
- Perturbating Intramolecular Hydrogen Bonds through Substituent Effects or Non-Covalent Interactions. Al Mokhtar Lamsabhi, Otilia Mó, Manuel Yáñez. Molecules 26, 3556 (2021)
- Water biocatalytic effect attenuates cytochrome P450-mediated carcinogenicity of diethylnitrosamine: A computational insight. Emadeldin M. Kamel, Al Mokhtar Lamsabhi. Organic & Biomolecular Chemistry, 19 (41), 9031 – 9042 (2021)
- A study using QSAR/QSPR models focused on the possible occurrence and risk of alloxydim residues from chlorinated drinking water, according to the EU Regulation. Juan José Villaverde, Beatriz Sevilla-Morán, José Luis Alonso-Prados, Pilar Sandín-España. Science of The Total Environment, 839, 156000 (2022) (Q1, IF = 10.754 – 2021)
