Sherlock—A Free and Open-Source System for the Computer-Assisted Structure Elucidation of Organic Compounds from NMR Data

The structure elucidation of small organic molecules (<1500 Dalton) through 1D and 2D nuclear magnetic resonance (NMR) data analysis is a potentially challenging, combinatorial problem. This publication presents Sherlock, a free and open-source Computer-Assisted Structure Elucidation (CASE) softw...

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Detalles Bibliográficos
Autores principales: Wenk, Michael, Nuzillard, Jean-Marc, Steinbeck, Christoph
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9920390/
https://www.ncbi.nlm.nih.gov/pubmed/36771127
http://dx.doi.org/10.3390/molecules28031448

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9920390/
https://www.ncbi.nlm.nih.gov/pubmed/36771127
http://dx.doi.org/10.3390/molecules28031448

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