Analysis of structure-selectivity relationships through single- or dual step selectivity searching using 2D molecular fingerprints
نویسندگان
چکیده
منابع مشابه
Analysis of Biological Screening Data and Molecular Selectivity Profiles Using Fingerprints and Mapping Algorithms
The identification of promising drug candidates is a major milestone in the early stages of drug discovery and design. Among the properties that have to be optimized before a drug candidate is admitted to clinical testing, potency and target selectivity are of great interest and can be addressed very early. Unfortunately, optimization–relevant knowledge is often limited, and the analysis of noi...
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ژورنال
عنوان ژورنال: Chemistry Central Journal
سال: 2009
ISSN: 1752-153X
DOI: 10.1186/1752-153x-3-s1-p4