Dose-sliced data collection: get the best from that crystal!
نویسندگان
چکیده
منابع مشابه
Get the best from substructure mining
The chemical information that is present in a set of compounds is rarely fully exploited. This is mostly because no descriptor set can capture all biologically important features. As a result, valuable chemical knowledge can thus stay hidden from hypothesis-based drug design. The simplest form of a structure-activity relationship (SAR) is a substructure that predisposes compounds towards reduce...
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ژورنال
عنوان ژورنال: Acta Crystallographica Section A Foundations and Advances
سال: 2018
ISSN: 2053-2733
DOI: 10.1107/s0108767318096915