MOESM2 of The influence of solid state information and descriptor selection on statistical models of temperature dependent aqueous solubility

Additional file 2. All QSPR ready datasets, prior to feature selection, associated with all considered sets of descriptors. N.B. In the case of the temperature (T) values, these were replaced with (1/T) using additional scripts prior to both feature selection and modelling.

附加文件2。所有适配定量构效关系（Quantitative Structure-Property Relationship, QSPR）的数据集均为特征选择前的版本，且与所有已考量的描述符集相关联。注意：针对温度（T）数值，在特征选择与建模两个环节之前，均通过额外脚本将其替换为(1/T)。