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Blog posts : "cheminformatics"

Multiomic Big Data Analysis Challenges: Increasing Confidence in the Interpretation of Artificial Intelligence Assessments (2021) Analytical Chemistry

Odenkirk MT, Reif DM, Baker ES. Multiomic Big Data Analysis Challenges: Increasing Confidence in the Interpretation of Artificial Intelligence Assessments. Anal Chem. 2021 May 24. doi: 10.1021/acs.analchem.0c04850. Epub ahead of print. PMID: 34029068.

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Graphic by Melanie Odenkirk makes the cover of the journal Analyst

https://pubs.rsc.org/en/content/articlelanding/2020/an/d0an90119a#!divAbstract

 

From the article: 

Structural-based connectivity and omic phenotype evaluations (SCOPE): a cheminformatics toolbox for investigating lipidomic changes in complex systems.

Odenkirk MT , Zin PPK , Ash JR , R…

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[COVER ARTICLE] Structural-based connectivity and omic phenotype evaluations (SCOPE): a cheminformatics toolbox for investigating lipidomic changes in complex systems (2020) Analyst

2020 Nov 9;145(22):7197-7209.
 doi: 10.1039/d0an01638a.

Structural-based connectivity and omic phenotype evaluations (SCOPE): a cheminformatics toolbox for investigating lipidomic changes in complex systems

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New P42 (Superfund Research Program) award: Center for Environmental and Human Health Effects of PFAS

See the full news release "NC State Receives $7.4 Million from NIEHS to Study PFAS Toxicity, Bioaccumulation and Remediation" @ https://news.ncsu.edu/2020/03/niehs-pfas-center/

David Reif and Denis Fourches will lead the Data Management and Analysis Core (DMAC) for the new center. More informat…

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4 blog posts