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Molecules 2010, 15(8), 5079-5092; doi:10.3390/molecules15085079
Article

Functionality Pattern Matching as an Efficient Complementary Structure/Reaction Search Tool: an Open-Source Approach

Received: 9 July 2010; in revised form: 22 July 2010 / Accepted: 26 July 2010 / Published: 27 July 2010
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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.
Keywords: open-source; checkmol; matchmol; functional groups; structure databases open-source; checkmol; matchmol; functional groups; structure databases
This is an open access article distributed under the Creative Commons Attribution License which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.

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MDPI and ACS Style

Haider, N. Functionality Pattern Matching as an Efficient Complementary Structure/Reaction Search Tool: an Open-Source Approach. Molecules 2010, 15, 5079-5092.

AMA Style

Haider N. Functionality Pattern Matching as an Efficient Complementary Structure/Reaction Search Tool: an Open-Source Approach. Molecules. 2010; 15(8):5079-5092.

Chicago/Turabian Style

Haider, Norbert. 2010. "Functionality Pattern Matching as an Efficient Complementary Structure/Reaction Search Tool: an Open-Source Approach." Molecules 15, no. 8: 5079-5092.


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