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Journal Article

The Chemistry Development Kit (CDK): An open-source Java library for chemo- and bioinformatics

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Steinbeck,  C.
Department of Bioorganic Chemistry, MPI for Chemical Ecology, Max Planck Society;

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Han,  Y. Q.
Department of Bioorganic Chemistry, MPI for Chemical Ecology, Max Planck Society;

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Kuhn,  S.
Department of Bioorganic Chemistry, MPI for Chemical Ecology, Max Planck Society;

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Citation

Steinbeck, C., Han, Y. Q., Kuhn, S., Horlacher, O., Luttmann, E., & Willighagen, E. (2003). The Chemistry Development Kit (CDK): An open-source Java library for chemo- and bioinformatics. Journal of Chemical Information and Computer Sciences, 43(2), 493-500. doi:10.1021/ci025584y.


Cite as: https://hdl.handle.net/11858/00-001M-0000-0012-A3C3-4
Abstract
The Chemistry Development Kit (CDK) is a freely available open- source Java library for Structural Chemo- and Bioinformatics. Its architecture and capabilities as well as the development as an open-source project by a team of international collaborators