split,split_filename,config_i,model_class,n_parameters,filename,features,labels,cache,extra_featurizers,use_2d,use_fp,dropout,ensemble_size,learning_rate,n_hidden,n_units,val_filename,epochs,batch_size,RMSE,Pearson r,Spearman rho
train,/nemo/lab/johnsone/home/users/johnsoe/data/datasets/thomas-2018-spark-wt/Escherichia-coli/scaffold-split-train.csv.gz,155,FPMLPModelBox,109635,/nemo/lab/johnsone/home/users/johnsoe/data/datasets/thomas-2018-spark-wt/Escherichia-coli/scaffold-split-train.csv.gz,['smiles'],['pmic'],/nemo/lab/johnsone/home/users/johnsoe/projects/abx-discovery-strategy/models/spark-dv-2503/Escherichia-coli/155/cache,,True,True,0.2,3,0.0001,3,16,/nemo/lab/johnsone/home/users/johnsoe/data/datasets/thomas-2018-spark-wt/Escherichia-coli/scaffold-split-validation.csv.gz,10000,16,0.43611055612564087,0.8981370945321865,0.8999000632718629
validation,/nemo/lab/johnsone/home/users/johnsoe/data/datasets/thomas-2018-spark-wt/Escherichia-coli/scaffold-split-validation.csv.gz,155,FPMLPModelBox,109635,/nemo/lab/johnsone/home/users/johnsoe/data/datasets/thomas-2018-spark-wt/Escherichia-coli/scaffold-split-train.csv.gz,['smiles'],['pmic'],/nemo/lab/johnsone/home/users/johnsoe/projects/abx-discovery-strategy/models/spark-dv-2503/Escherichia-coli/155/cache,,True,True,0.2,3,0.0001,3,16,/nemo/lab/johnsone/home/users/johnsoe/data/datasets/thomas-2018-spark-wt/Escherichia-coli/scaffold-split-validation.csv.gz,10000,16,0.6811274290084839,0.5463473339778666,0.521191628774788
test,/nemo/lab/johnsone/home/users/johnsoe/data/datasets/thomas-2018-spark-wt/Escherichia-coli/scaffold-split-test.csv.gz,155,FPMLPModelBox,109635,/nemo/lab/johnsone/home/users/johnsoe/data/datasets/thomas-2018-spark-wt/Escherichia-coli/scaffold-split-train.csv.gz,['smiles'],['pmic'],/nemo/lab/johnsone/home/users/johnsoe/projects/abx-discovery-strategy/models/spark-dv-2503/Escherichia-coli/155/cache,,True,True,0.2,3,0.0001,3,16,/nemo/lab/johnsone/home/users/johnsoe/data/datasets/thomas-2018-spark-wt/Escherichia-coli/scaffold-split-validation.csv.gz,10000,16,0.6774232983589172,0.6967744273372313,0.6465137335847693