candidate,part,subset,targets,pairs,MAE,MAE_sd,RMSE,R2,Spearman
Mean,test,all,162,21090,0.9495246833195692,0.0,1.1564466482275042,-0.13296190421173085,
Mean,test,changed,74,905,1.005981205477593,0.0,1.114120089326329,-9.568408505578125,
Median,test,all,162,21090,0.9450617144857044,0.0,1.170715707198003,-0.14179566012224354,
Median,test,changed,74,905,0.9986137803698664,0.0,1.1058377353938853,-8.418904170286828,
RF_full,test,all,162,21090,0.5813735816885546,0.002001902604488259,0.7565250514569893,0.47928223583033325,0.6862534702922017
RF_full,test,changed,74,905,0.6339141778685757,0.010010055601809101,0.7174628529733013,-1.6558024749406233,0.5761837839663078
RF_full_descriptors,test,all,162,21090,0.5762138028059852,0.0007505100112014883,0.7481074838601868,0.489073292968989,0.6940319896023346
RF_full_descriptors,test,changed,74,905,0.6224352707352755,0.007186797348515303,0.7035948226338263,-1.7182058744000799,0.6112827758847021
Tanimoto_1NN,test,all,162,21090,0.7094985304748236,0.0,0.9604863290565322,0.1287489743919246,0.5780287686151654
Tanimoto_1NN,test,changed,74,905,0.6706243809689447,0.0,0.7841989554870684,-2.096741797304502,0.5700891945620551
Tanimoto_5NN,test,all,162,21090,0.6158786455588742,0.0,0.8091930623632135,0.389361312848447,0.6414805080146389
Tanimoto_5NN,test,changed,74,905,0.6254415422581941,0.0,0.7140526316395106,-2.097270229110075,0.5089634973344562