基于分子指纹和拓扑指数的工质临界温度理论预测

任嘉辉,刘豫,刘朝,刘浪,李莹

Critical temperature prediction of working fluids using molecular fingerprints and topological indices

Jiahui REN,Yu LIU,Chao LIU,Lang LIU,Ying LI

图1 以不同指纹为输入的各QSPR模型的预测精度

Fig.1 Prediction accuracy of QSPR models with different fingerprints as inputs