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Unique identifiers for small molecules enable rigorous labeling of their atoms

Rigorous characterization of small organic molecules in terms of their structural and biological properties is vital to biomedical research. The three-dimensional structure of a molecule, its ‘photo ID’, is inefficient for searching and matching tasks. Instead, identifiers play a key role in accessi...

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Shranjeno v:
Bibliografske podrobnosti
izdano v:Sci Data
Main Authors: Dashti, Hesam, Westler, William M., Markley, John L., Eghbalnia, Hamid R.
Format: Artigo
Jezik:Inglês
Izdano: Nature Publishing Group 2017
Teme:
Online dostop:https://ncbi.nlm.nih.gov/pmc/articles/PMC5441290/
https://ncbi.nlm.nih.gov/pubmed/28534867
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/sdata.2017.73
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