inSARa: intuitive single-target (large-scale) SAR interpretation and multi-target cross-reactivity analysis
نویسندگان
چکیده
منابع مشابه
inSARa: intuitive single-target (large-scale) SAR interpretation and multi-target cross-reactivity analysis
inSARa (intuitive networks for Structure-ActivityRelationships analysis) was primarily developed with the objective to support the medicinal chemist in tackling SAR analysis and visualization of large data sets in a more intuitive way than fingerprint-based approaches [1]. The method takes advantage of the synergic combination of the reduced graph (RG) and the maximum common substructure (MCS) ...
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ژورنال
عنوان ژورنال: Journal of Cheminformatics
سال: 2014
ISSN: 1758-2946
DOI: 10.1186/1758-2946-6-s1-o18