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Uncovering activity cliff generators using distribution of SALI values
Activity cliffs are defined as compounds with high structure similarity but large potency difference. Identification ofactivity cliffs have a significant impact in lead optimization in medicinal chemistry, and computational applicationssuch as the development of predictive models and the selection o...
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| Опубликовано в: : | Tip Revista Especializada en Ciencias Químico-Biológicas |
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| Главные авторы: | , |
| Формат: | Artigo |
| Язык: | Inglês |
| Опубликовано: |
Universidad Nacional Autónoma de México
2018
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| Предметы: | |
| Online-ссылка: | https://www.redalyc.org/articulo.oa?id=43253401002 |
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