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S66: A Well-balanced Database of Benchmark Interaction Energies Relevant to Biomolecular Structures
With numerous new quantum chemistry methods being developed in recent years and the promise of even more new methods to be developed in the near future, it is clearly critical that highly accurate, well-balanced, reference data for many different atomic and molecular properties be available for the...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2011
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3152974/ https://www.ncbi.nlm.nih.gov/pubmed/21836824 http://dx.doi.org/10.1021/ct2002946 |