Assessing Synthetic Accessibility of Chemical Compounds Using Machine Learning Methods
نویسندگان
چکیده
منابع مشابه
Assessing Synthetic Accessibility of Chemical Compounds Using Machine Learning Methods
With de novo rational drug design, scientists can rapidly generate a very large number of potentially biologically active probes. However, many of them may be synthetically infeasible and, therefore, of limited value to drug developers. On the other hand, most of the tools for synthetic accessibility evaluation are very slow and can process only a few molecules per minute. In this study, we pre...
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ژورنال
عنوان ژورنال: Journal of Chemical Information and Modeling
سال: 2010
ISSN: 1549-9596,1549-960X
DOI: 10.1021/ci900301v