Prediction of melting point temperatures and enthalpies of fusion for pure wax esters using a group contribution model
收藏资源简介:
This data set contains the following files: 1. 'all experimental data WEs _references.xlsx' - all experimental data for wax esters from various literature sources (references directly in the file) 2. 'alldata 24-48.xlsx' - reduced data set that was used for modeling3. 'WE-modeling_dsdh_TAGcomparison_final results.xlsx' - TAG and WE data used for model comparisons; data to check the correlation of dh and ds for wax esters; final results of modeling with calculation of RMSE for each category of wax esters
本数据集包含以下文件:1. 'all experimental data WEs _references.xlsx':收录了各类文献来源的蜡酯(wax esters)实验数据,文献引用信息已直接标注于该文件内。2. 'alldata 24-48.xlsx':用于建模的精简数据集。3. 'WE-modeling_dsdh_TAGcomparison_final results.xlsx':用于模型对比的三酰甘油(TAG)与蜡酯数据;用于检验蜡酯dh与ds相关性的数据集;以及针对每一类蜡酯计算均方根误差(RMSE)后的建模最终结果。



