| Literature DB >> 23696035 |
Paola Gramatica, Simona Kovarich, Partha Pratim Roy.
Abstract
We appreciate the interest of Dr. Rayne on our article and we completely agree that the dataset of (benzo-)triazoles, which were screened by the hydroxyl radical reaction quantitative structure-activity relationship (QSAR) model, was not only composed of benzo-triazoles but also included some simpler triazoles (without the condensed benzene ring), such as the chemicals listed by Dr. Rayne, as well as some related heterocycles (also few not aromatic). We want to clarify that in this article (as well as in other articles in which the same dataset was screened), for conciseness, the abbreviations (B)TAZs and BTAZs were used as general (and certainly too simplified) notations meaning an extended dataset of benzo-triazoles, triazoles, and related compounds.Entities:
Year: 2013 PMID: 23696035 DOI: 10.1002/jcc.23321
Source DB: PubMed Journal: J Comput Chem ISSN: 0192-8651 Impact factor: 3.376