Pesticides, cosmetics, drugs: identical and opposite influences of various molecular features as measures of endpoints similarity and dissimilarity
| العنوان: | Pesticides, cosmetics, drugs: identical and opposite influences of various molecular features as measures of endpoints similarity and dissimilarity |
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| المؤلفون: | Andrey A. Toropov, Gianluca Selvestrel, Alla P. Toropova, Marco Marzo, Emilio Benfenati, Edoardo Carnesecchi |
| المصدر: | Molecular Diversity. 25:1137-1144 |
| بيانات النشر: | Springer Science and Business Media LLC, 2020. |
| سنة النشر: | 2020 |
| مصطلحات موضوعية: | Anti hiv activity, Quantitative structure–activity relationship, 010405 organic chemistry, media_common.quotation_subject, Organic Chemistry, food and beverages, Quantitative structure, General Medicine, Computational biology, Biology, Pesticide, 010402 general chemistry, 01 natural sciences, Cosmetics, Catalysis, 0104 chemical sciences, Inorganic Chemistry, Similarity (network science), Drug Discovery, Physical and Theoretical Chemistry, Molecular Biology, Information Systems, media_common |
| الوصف: | The similarity is an important category in natural sciences. A measure of similarity for a group of various biochemical endpoints is suggested. The list of examined endpoints contains (1) toxicity of pesticides towards rainbow trout; (2) human skin sensitization; (3) mutagenicity; (4) toxicity of psychotropic drugs; and (5) anti HIV activity. Further applying and evolution of the suggested approach is discussed. In particular, the conception of the similarity (dissimilarity) of endpoints can play the role of a “useful bridge” between quantitative structure property/activity relationships (QSPRs/QSARs) and read-across technique. |
| تدمد: | 1573-501X 1381-1991 |
| URL الوصول: | https://explore.openaire.eu/search/publication?articleId=doi_________::620c8f1eaf43eccb94b9ae0c28bb9742 https://doi.org/10.1007/s11030-020-10085-3 |
| حقوق: | CLOSED |
| رقم الأكسشن: | edsair.doi...........620c8f1eaf43eccb94b9ae0c28bb9742 |
| قاعدة البيانات: | OpenAIRE |
Find this article in full text from Springer Verlag. | تدمد: | 1573501X 13811991 |
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