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Publikováno v:
J Chem Inf Model
In silico metabolism prediction is a cheminformatic task of autonomously predicting the set of metabolic byproducts produced from a specified molecule and a set of enzymes or reactions. Here, we describe a novel machine learned in silico cytochrome P
Autor:
Sunil V. Kalmady, Kejia Yan, Kwami Aku-Dominguez, Alex Brown, Sharyar Memon, Russell Greiner, Ratmir Derda, Vivian Triana
The Wittig reaction can be used for late stage functionalization of proteins and peptides to ligate glycans, pharmacophores, and many other functionalities. In this manuscript, we modified 160,000 N-terminal glyoxaldehyde peptides displayed on phage
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::0d0363010799b5c3fa444a8d54dc98db
https://doi.org/10.26434/chemrxiv.14609670.v1
https://doi.org/10.26434/chemrxiv.14609670.v1
Autor:
Carolyn M. Slupsky, and Brian D. Sykes, David Chang, Russell Greiner, Hao Fu, Darryl J. Adamko, Bruce Lix, Erik J. Saude, Thomas J. Marrie, James Wagner, Sirish L. Shah, Aalim M. Weljie, Kathryn N. Rankin
Publikováno v:
Analytical Chemistry. 79:6995-7004
Metabolomics may have the capacity to revolutionize disease diagnosis through the identification of scores of metabolites that vary during environmental, pathogenic, or toxicological insult. NMR spectroscopy has become one of the main tools for measu