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Ligandbook: an online repository for small and drug-like molecule force field parameters

SUMMARY: Ligandbook is a public database and archive for force field parameters of small and drug-like molecules. It is a repository for parameter sets that are part of published work but are not easily available to the community otherwise. Parameter sets can be downloaded and immediately used in mo...

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Detalles Bibliográficos
Autores principales: Domański, Jan, Beckstein, Oliver, Iorga, Bogdan I
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Oxford University Press 2017
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5447236/
https://www.ncbi.nlm.nih.gov/pubmed/28130228
http://dx.doi.org/10.1093/bioinformatics/btx037