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Open Babel: An open chemical toolbox
BACKGROUND: A frequent problem in computational modeling is the interconversion of chemical structures between different formats. While standard interchange formats exist (for example, Chemical Markup Language) and de facto standards have arisen (for example, SMILES format), the need to interconvert...
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Main Authors: | , , , , , |
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Formato: | Artigo |
Idioma: | Inglês |
Publicado em: |
BioMed Central
2011
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Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3198950/ https://ncbi.nlm.nih.gov/pubmed/21982300 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/1758-2946-3-33 |
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