Ana Yisel Caballero Alfonso

Ana Yisel Caballero Alfonso

European Chemicals Agency - Helsinki / Denmark
Engineering & Technology / Computer Science
AD Scientific Index ID: 4655676
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person_outline Ana Yisel Caballero Alfonso's MOST POPULAR ARTICLES
1-) Homology modeling of the human p-glycoprotein (Abcb1) and insights into ligand binding through molecular docking studiesL Mora Lagares, N Minovski, AY Caballero Alfonso, E Benfenati, ...International journal of molecular sciences 21 (11), 4058, 2020212020
2-) Ensemble-based modeling of chemical compounds with antimalarial activityAY Caballero-Alfonso, M Cruz-Monteagudo, E Tejera, E Benfenati, ...Current Topics in Medicinal Chemistry 19 (11), 957-969, 201992019
3-) Towards an understanding of the mode of action of human aromatase activity for azoles through quantum chemical descriptors-based regression and structure activity relationship …C Chayawan, C Toma, E Benfenati, AY Caballero AlfonsoMolecules 25 (3), 739, 202082020
4-) A KNIME workflow to assist the analogue identification for read-across, applied to aromatase activityAY Caballero Alfonso, C Chayawan, D Gadaleta, A Roncaglioni, ...Molecules 28 (4), 1832, 202362023
5-) Skin sensitization quantitative QSAR models based on mechanistic structural alertsG Selvestrel, D Baderna, C Toma, AYC Alfonso, A Gamba, E BenfenatiToxicology 468, 153111, 202262022