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Prediction of hydrolysis products of organic chemicals under environmental pH conditions

Cheminformatics-based software tools can predict the molecular structure of transformation products using a library of transformation reaction schemes. This paper presents the development of such a library for abiotic hydrolysis of organic chemicals under environmentally relevant conditions. The hyd...

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Shranjeno v:
Bibliografske podrobnosti
izdano v:Environ Sci Technol
Main Authors: Tebes-Stevens, Caroline, Patel, Jay M., Jones, W. Jack, Weber, Eric J.
Format: Artigo
Jezik:Inglês
Izdano: 2017
Teme:
Online dostop:https://ncbi.nlm.nih.gov/pmc/articles/PMC6776422/
https://ncbi.nlm.nih.gov/pubmed/28430419
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.est.6b05412
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