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Computational methods for prediction of in vitro effects of new chemical structures

BACKGROUND: With a constant increase in the number of new chemicals synthesized every year, it becomes important to employ the most reliable and fast in silico screening methods to predict their safety and activity profiles. In recent years, in silico prediction methods received great attention in a...

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Bibliografiske detaljer
Udgivet i:J Cheminform
Main Authors: Banerjee, Priyanka, Siramshetty, Vishal B., Drwal, Malgorzata N., Preissner, Robert
Format: Artigo
Sprog:Inglês
Udgivet: Springer International Publishing 2016
Fag:
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC5043617/
https://ncbi.nlm.nih.gov/pubmed/28316649
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/s13321-016-0162-2
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