{"id":"CONICETDig_b3e1eef0d8f0da84766ed5ddbe8e3329","dc:title":"Ames Mutagenicity Dataset","dc:creator":"Ponzoni, Ignacio","dc:date":"2024","dc:description":["El dataset contiene 5536 compuestos moleculares representados por su c\u00f3digo SMILES y 1360 descriptores moleculares calculados con Mordred. Adem\u00e1s, contiene las respectivas etiquetas para cada compuesto (1: mutag\u00e9nico \/ 0: no mutag\u00e9nico) para cada una de las cinco cepas (TA98, TA100, TA102, TA1535, TA1537) y una etiqueta general (Overall) que corresponde a la etiqueta de consenso utilizada para evaluar la predicci\u00f3n final del test de Ames. Los compuestos fueron compilados originalmente por el Istituto Superiore di Sanita\u2019 (https:\/\/www.iss.it\/isstox) y son el resultado de una etapa de preprocesamiento exhaustiva, que consta de diferentes pasos de filtrado, limpieza y canonicalizaci\u00f3n. The dataset contains 5,536 molecular compounds represented by their SMILES code and 1,360 molecular descriptors calculated with Mordred. Moreover, it contains the respective labels for each compound (1: mutagenic \/ 0: non-mutagenic) for each of the five strains (TA98, TA100, TA102, TA1535, TA1537) and a general label (Overall) that corresponds to the ground-truth consensus label used for evaluating the final Ames mutagenicity prediction. The compounds listed were originally compiled by the Istituto Superiore di Sanita\u2019 (https:\/\/www.iss.it\/isstox) and result from an exhaustive pre-processing stage, consisting of different filtering, sanitization, and canonicalization steps."],"dc:format":["text\/plain","application\/octet-stream"],"dc:language":["zxx"],"dc:type":"dataset","dc:rights":["info:eu-repo\/semantics\/openAccess","https:\/\/creativecommons.org\/licenses\/by-nc-sa\/2.5\/ar\/"],"dc:identifier":"https:\/\/repositoriosdigitales.mincyt.gob.ar\/vufind\/Record\/CONICETDig_b3e1eef0d8f0da84766ed5ddbe8e3329"}