Functionality Pattern Matching as an Efficient Complementary Structure/Reaction Search Tool: an Open-Source Approach
Norbert Haider
Molecules · 2010
doi:10.3390/molecules15085079 (opens in a new tab)
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Abstract
An open-source software package for creating and operating web-based structure and/or reaction databases is presented. Besides standard search capabilities (text, structure/substructure/similarity), the system offers a fast additional search option, entirely based on binary pattern matching, which uses automatically assigned functional group descriptors.
Abstract licence: CC BY
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