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Pybel: a Python wrapper for the OpenBabel cheminformatics toolkit

BACKGROUND: Scripting languages such as Python are ideally suited to common programming tasks in cheminformatics such as data analysis and parsing information from files. However, for reasons of efficiency, cheminformatics toolkits such as the OpenBabel toolkit are often implemented in compiled lang...

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Autors principals: O'Boyle, Noel M, Morley, Chris, Hutchison, Geoffrey R
Format: Artigo
Idioma:Inglês
Publicat: BioMed Central 2008
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC2270842/
https://ncbi.nlm.nih.gov/pubmed/18328109
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/1752-153X-2-5
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