New Publicly Available Chemical Query Language, CSRML, To Support Chemotype Representations for Application to Data Mining and Modeling." J. Chem. Inf. Model.. 2015;55(3):510-528. Abstract
"CSRML
QSAR Modeling: Where Have You Been? Where Are You Going To?" Journal of Medicinal Chemistry. 2014;57(12):4977-5010. Abstract
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Applications of Integrated Data Mining Methods to Exploring Natural Product Space for Acetylcholinesterase Inhibitors." Comb. Chem. & HTS. 2010;13(1):54-66. Abstract
"CORINA, ADRIANA.Code, SONNIA
Exploring Potency and Selectivity Receptor Antagonist Profiles Using a Multilabel Classification Approach: The Human Adenosine Receptors as a Key Study." J. Chem. Inf. Model.. 2009;49(12):2820-2836. Abstract
"ADRIANA.Code, CORINA
Comparison of Multilabel and Single-Label Classification Applied to the Prediction of the Isoform Specificity of Cytochrome P450 Substrates." J. Chem. Inf. Model.. 2009;49(11):2588-2605. Abstract
"ADRIANA.Code, SONNIA
Molecular properties of psychopharmacological drugs determining non-competitive inhibition of 5-HT3A receptors." Eur. J. Med. Chem.. 2009;44(6):2667-2672. Abstract
"ADRIANA.Code
Neural Networks as Valuable Tools To Differentiate between Sesquiterpene Lactones’ Inhibitory Activity on Serotonin Release and on NF-κB." J. Med. Chem.. 2008;51(5):1324-1332. Abstract
"CORINA, ADRIANA.Code, SONNIA
Identification of New Functional Inhibitors of Acid Sphingomyelinase Using a Structure−Property−Activity Relation Model." J. Med. Chem.. 2008;51(2):219-237. Abstract
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Ligand-Based Models for the Isoform Specificity of Cytochrome P450 3A4, 2D6, and 2C9 Substrates." J. Chem. Inf. Model.. 2007;47(4):1688-1701. Abstract
"isoCYP
Self-Organizing Maps for Identification of New Inhibitors of P-Glycoprotein." J. Med. Chem.. 2007;50(7):1698-1702. Abstract
"PETRA, AUTOCORR, SONNIA
Development of a Structural Model for NF-κB Inhibition of Sesquiterpene Lactones Using Self-Organizing Neural Networks." J. Med. Chem.. 2006;49(7):2241-2252. Abstract
"CORINA, PETRA, SURFACE, ARDF, RCODE, SONNIA
Sesquiterpene lactone-based classification of three Asteraceae tribes: a study based on self-organizing neural networks applied to chemosystematics." Phytochemistry. 2005;66(3):345-353. Abstract
"CORINA, ADRIANA.Code, SONNIA
Neural networks as data mining tools in drug design." J. Phys. Org. Chem.. 2003;16(4):232-245. Abstract
"CORINA, PETRA, SONNIA