Quantitative Structure−Property Relationship for Prediction of the Lower Flammability Limit of Pure Compounds
收藏NIAID Data Ecosystem2026-03-09 收录
下载链接：
https://figshare.com/articles/dataset/Quantitative_Structure_Property_Relationship_for_Prediction_of_the_Lower_Flammability_Limit_of_Pure_Compounds/2010900
下载链接
链接失效反馈官方服务：
资源简介：
A quantitative structure−property relationship (QSPR) study
was performed to develop a model for prediction of the lower flammability
limit (LFL) of pure compounds. The obtained model is a four-parameter
multilinear equation. These four parameters are calculated from the
chemical structure of every molecule. The average absolute error,
squared correlation coefficient, and root mean squares of error of
the obtained model over all 1056 pure compounds used to develop the
model are 7.68%, 0.9698, and 0.084, respectively.
创建时间：
2015-12-16
