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The semantics of Chemical Markup Language (CML) for computational chemistry : CompChem
This paper introduces a subdomain chemistry format for storing computational chemistry data called CompChem. It has been developed based on the design, concepts and methodologies of Chemical Markup Language (CML) by adding computational chemistry semantics on top of the CML Schema. The format allows...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
BioMed Central
2012
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3434037/ https://www.ncbi.nlm.nih.gov/pubmed/22870956 http://dx.doi.org/10.1186/1758-2946-4-15 |