The Blue Obelisk-interoperability in chemical informatics.
The Blue Obelisk-interoperability in chemical informatics.
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DOI:
10.1021/ci050400b
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发表时间:
2006-05
影响因子:
5.6
通讯作者:
Willighagen EL
中科院分区:
文献类型:
--
作者:
Guha R;Howard MT;Hutchison GR;Murray-Rust P;Rzepa H;Steinbeck C;Wegner J;Willighagen EL
The Blue Obelisk Movement () is the name used by a diverse Internet group promoting reusable chemistry via open source software development, consistent and complimentary chemoinformatics research, open data, and open standards. We outline recent examples of cooperation in the Blue Obelisk group: a shared dictionary of algorithms and implementations in chemoinformatics algorithms drawing from our various software projects; a shared repository of chemoinformatics data including elemental properties, atomic radii, isotopes, atom typing rules, and so forth; and Web services for the platform-independent use of chemoinformatics programs.