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Molecular Property Prediction on SIDER 50-shot (test)

0.5546ROC-AUCGPF-plus
0.493760.5095550.525350.541145Sep 30, 2022Dec 23, 2022Mar 17, 2023Jun 9, 2023Sep 1, 2023Nov 24, 2023Feb 16, 2024

Evaluation results

MethodLinks
GPF-plusPre-training Strategy=GCL2022.090.5546
GPFPre-training Strategy=GCL2022.090.5386
Fine-tuningPre-training Strategy=GCL2022.090.5323
FTPre-training strategy=GCL, Shots=502024.020.5323
SUPThardPre-training strategy=EdgePred, Shots=502024.020.5256
SUPTsoftPre-training strategy=EdgePred, Shots=502024.020.5245
SUPThardPre-training strategy=ContextPred, Shots=502024.020.5225
SUPTsoftPre-training strategy=ContextPred, Shots=502024.020.5225
SUPTsoftPre-training strategy=GCL, Shots=502024.020.52
SUPThardPre-training strategy=GCL, Shots=502024.020.5195
SUPTsoftPre-training strategy=AttrMasking, Shots=502024.020.5166
SUPThardPre-training strategy=Infomax, Shots=502024.020.5156
SUPThardPre-training strategy=AttrMasking, Shots=502024.020.5154
SUPTsoftPre-training strategy=Infomax, Shots=502024.020.5151
GPF-plusPre-training Strategy=ContextPred2022.090.5144
GPFPre-training Strategy=EdgePred2022.090.5135
GPF-plusPre-training Strategy=Infomax2022.090.5133
Fine-tuningPre-training Strategy=EdgePred2022.090.513
GPF-plusPre-training Strategy=EdgePred2022.090.513
FTPre-training strategy=EdgePred, Shots=502024.020.513
Fine-tuningPre-training Strategy=Infomax2022.090.5077
FTPre-training strategy=Infomax, Shots=502024.020.5077
GPFPre-training Strategy=AttrMasking2022.090.5062
GPFPre-training strategy=GCL, Shots=502024.020.5056
GPFPre-training Strategy=ContextPred2022.090.5054
GPF-plusPre-training Strategy=AttrMasking2022.090.503
GPFPre-training Strategy=Infomax2022.090.5029
GPFPre-training strategy=ContextPred, Shots=502024.020.5023
GPF-plusPre-training strategy=Infomax, Shots=502024.020.502
GPFPre-training strategy=Infomax, Shots=502024.020.5019
GPF-plusPre-training strategy=AttrMasking, Shots=502024.020.5019
GPF-plusPre-training strategy=ContextPred, Shots=502024.020.5019
GPF-plusPre-training strategy=EdgePred, Shots=502024.020.5018
Fine-tuningPre-training Strategy=AttrMasking2022.090.5011
FTPre-training strategy=AttrMasking, Shots=502024.020.5011
GPF-plusPre-training strategy=GCL, Shots=502024.020.5008
GPFPre-training strategy=EdgePred, Shots=502024.020.499
Fine-tuningPre-training Strategy=ContextPred2022.090.4989
FTPre-training strategy=ContextPred, Shots=502024.020.4989
GPFPre-training strategy=AttrMasking, Shots=502024.020.4961