Data
QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310

QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310

deactivated ARFF Publicly available Visibility: public Uploaded 15-07-2016 by Noureddin Sadawi
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This dataset contains QSAR data (from ChEMBL version 17) showing activity values (unit is pseudo-pCI50) of several compounds on drug target ChEMBL_ID: CHEMBL5310 (TID: 100908), and it has 84 rows and 325 features (not including molecule IDs and class feature: molecule_id and pXC50). The features represent Molecular Descriptors which were generated from SMILES strings. Missing value imputation was applied to this dataset (By choosing the Median). Feature selection was also applied.

327 features

pXC50 (target)numeric21 unique values
0 missing
molecule_id (row identifier)nominal84 unique values
0 missing
Chi1_EA.bo.numeric84 unique values
0 missing
AACnumeric77 unique values
0 missing
Chi1_EA.dm.numeric83 unique values
0 missing
AECCnumeric84 unique values
0 missing
Chi1_EA.ed.numeric84 unique values
0 missing
ALOGPnumeric84 unique values
0 missing
Chi1_EA.ri.numeric84 unique values
0 missing
ALOGP2numeric84 unique values
0 missing
CIC0numeric81 unique values
0 missing
AMRnumeric84 unique values
0 missing
CIC1numeric82 unique values
0 missing
AMWnumeric80 unique values
0 missing
CIC2numeric78 unique values
0 missing
ARRnumeric67 unique values
0 missing
CIC3numeric82 unique values
0 missing
ATS1enumeric77 unique values
0 missing
CIC4numeric80 unique values
0 missing
ATS1inumeric79 unique values
0 missing
CIC5numeric79 unique values
0 missing
ATS1mnumeric79 unique values
0 missing
CIDnumeric79 unique values
0 missing
ATS1pnumeric79 unique values
0 missing
Cl.089numeric3 unique values
0 missing
ATS1snumeric78 unique values
0 missing
CMC.50numeric2 unique values
0 missing
ATS1vnumeric77 unique values
0 missing
CMC.80numeric2 unique values
0 missing
ATS2enumeric77 unique values
0 missing
cRo5numeric2 unique values
0 missing
ATS2inumeric80 unique values
0 missing
CSInumeric82 unique values
0 missing
ATS2mnumeric82 unique values
0 missing
DBInumeric35 unique values
0 missing
ATS2pnumeric80 unique values
0 missing
D.Dtr03numeric6 unique values
0 missing
ATS2snumeric83 unique values
0 missing
D.Dtr05numeric59 unique values
0 missing
ATS2vnumeric83 unique values
0 missing
D.Dtr06numeric84 unique values
0 missing
ATS3enumeric83 unique values
0 missing
D.Dtr07numeric7 unique values
0 missing
ATS3inumeric80 unique values
0 missing
D.Dtr08numeric3 unique values
0 missing
ATS3mnumeric80 unique values
0 missing
D.Dtr09numeric39 unique values
0 missing
ATS3pnumeric80 unique values
0 missing
D.Dtr10numeric34 unique values
0 missing
ATS3snumeric78 unique values
0 missing
D.Dtr11numeric6 unique values
0 missing
ATS3vnumeric81 unique values
0 missing
D.Dtr12numeric6 unique values
0 missing
ATS4enumeric81 unique values
0 missing
DECCnumeric83 unique values
0 missing
ATS4inumeric83 unique values
0 missing
DELSnumeric84 unique values
0 missing
ATS4mnumeric78 unique values
0 missing
Depressant.50numeric2 unique values
0 missing
ATS4pnumeric79 unique values
0 missing
Depressant.80numeric2 unique values
0 missing
ATS4snumeric83 unique values
0 missing
DLS_01numeric3 unique values
0 missing
ATS4vnumeric83 unique values
0 missing
DLS_02numeric5 unique values
0 missing
ATS5enumeric82 unique values
0 missing
DLS_03numeric3 unique values
0 missing
ATS5inumeric82 unique values
0 missing
DLS_04numeric8 unique values
0 missing
ATS5mnumeric82 unique values
0 missing
DLS_05numeric3 unique values
0 missing
ATS5pnumeric82 unique values
0 missing
DLS_06numeric3 unique values
0 missing
ATS5snumeric83 unique values
0 missing
DLS_07numeric2 unique values
0 missing
ATS5vnumeric81 unique values
0 missing
DLS_consnumeric24 unique values
0 missing
ATS6enumeric80 unique values
0 missing
Dznumeric62 unique values
0 missing
ATS6inumeric81 unique values
0 missing
ECCnumeric83 unique values
0 missing
ATS6mnumeric79 unique values
0 missing
Eig01_AEA.bo.numeric73 unique values
0 missing
ATS6pnumeric81 unique values
0 missing
Eig01_AEA.dm.numeric73 unique values
0 missing
ATS6snumeric81 unique values
0 missing
Eig01_AEA.ed.numeric75 unique values
0 missing
ATS6vnumeric81 unique values
0 missing
Eig01_AEA.ri.numeric76 unique values
0 missing
ATS7enumeric82 unique values
0 missing
Eig01_EAnumeric70 unique values
0 missing
ATS7inumeric81 unique values
0 missing
Eig01_EA.bo.numeric69 unique values
0 missing
ATS7mnumeric83 unique values
0 missing
Eig01_EA.dm.numeric35 unique values
0 missing
ATS7pnumeric83 unique values
0 missing
Eig01_EA.ed.numeric77 unique values
0 missing
ATS7snumeric82 unique values
0 missing
Eig01_EA.ri.numeric72 unique values
0 missing
ATS7vnumeric81 unique values
0 missing
Eig02_AEA.bo.numeric77 unique values
0 missing
ATS8enumeric81 unique values
0 missing
Eig02_AEA.dm.numeric81 unique values
0 missing
ATS8inumeric83 unique values
0 missing
Eig02_AEA.ed.numeric81 unique values
0 missing
ATS8mnumeric83 unique values
0 missing
Eig02_AEA.ri.numeric79 unique values
0 missing
ATS8pnumeric83 unique values
0 missing
Eig02_EAnumeric78 unique values
0 missing
ATS8snumeric83 unique values
0 missing
Eig02_EA.bo.numeric76 unique values
0 missing
ATS8vnumeric81 unique values
0 missing
Eig02_EA.dm.numeric26 unique values
0 missing
ATSC1enumeric71 unique values
0 missing
Eig02_EA.ed.numeric83 unique values
0 missing
ATSC1inumeric79 unique values
0 missing
Eig02_EA.ri.numeric76 unique values
0 missing
ATSC1mnumeric82 unique values
0 missing
Eig03_AEA.bo.numeric81 unique values
0 missing
ATSC1pnumeric83 unique values
0 missing
Eig03_AEA.dm.numeric81 unique values
0 missing
ATSC1snumeric84 unique values
0 missing
Eig03_AEA.ed.numeric79 unique values
0 missing
ATSC1vnumeric83 unique values
0 missing
Eig03_AEA.ri.numeric79 unique values
0 missing
ATSC2enumeric76 unique values
0 missing
Eig03_EAnumeric77 unique values
0 missing
ATSC2inumeric80 unique values
0 missing
Eig03_EA.bo.numeric78 unique values
0 missing
ATSC2mnumeric83 unique values
0 missing
Eig03_EA.dm.numeric17 unique values
0 missing
ATSC2pnumeric83 unique values
0 missing
Eig03_EA.ed.numeric83 unique values
0 missing
ATSC2snumeric84 unique values
0 missing
Eig03_EA.ri.numeric81 unique values
0 missing
ATSC2vnumeric84 unique values
0 missing
Eig04_AEA.bo.numeric77 unique values
0 missing
ATSC3enumeric80 unique values
0 missing
Eig04_AEA.dm.numeric81 unique values
0 missing
ATSC3inumeric82 unique values
0 missing
Eig04_AEA.ed.numeric82 unique values
0 missing
ATSC3mnumeric84 unique values
0 missing
ATSC3pnumeric83 unique values
0 missing
ATSC3snumeric84 unique values
0 missing
ATSC3vnumeric83 unique values
0 missing
ATSC4enumeric79 unique values
0 missing
ATSC4inumeric81 unique values
0 missing
ATSC4mnumeric84 unique values
0 missing
ATSC4pnumeric84 unique values
0 missing
ATSC4snumeric84 unique values
0 missing
ATSC4vnumeric84 unique values
0 missing
ATSC5enumeric83 unique values
0 missing
ATSC5inumeric83 unique values
0 missing
ATSC5mnumeric84 unique values
0 missing
ATSC5pnumeric84 unique values
0 missing
ATSC5snumeric84 unique values
0 missing
ATSC5vnumeric84 unique values
0 missing
ATSC6enumeric83 unique values
0 missing
ATSC6inumeric82 unique values
0 missing
ATSC6mnumeric84 unique values
0 missing
ATSC6pnumeric83 unique values
0 missing
ATSC6snumeric84 unique values
0 missing
ATSC6vnumeric83 unique values
0 missing
ATSC7enumeric82 unique values
0 missing
ATSC7inumeric82 unique values
0 missing
ATSC7mnumeric84 unique values
0 missing
ATSC7pnumeric83 unique values
0 missing
ATSC7snumeric84 unique values
0 missing
ATSC7vnumeric84 unique values
0 missing
ATSC8enumeric83 unique values
0 missing
ATSC8inumeric81 unique values
0 missing
ATSC8mnumeric84 unique values
0 missing
ATSC8pnumeric84 unique values
0 missing
ATSC8snumeric84 unique values
0 missing
ATSC8vnumeric84 unique values
0 missing
BACnumeric38 unique values
0 missing
BBInumeric36 unique values
0 missing
BIC0numeric56 unique values
0 missing
BIC1numeric67 unique values
0 missing
BIC2numeric66 unique values
0 missing
BIC3numeric61 unique values
0 missing
BIC4numeric59 unique values
0 missing
BIC5numeric59 unique values
0 missing
BIDnumeric48 unique values
0 missing
BLInumeric67 unique values
0 missing
BLTA96numeric76 unique values
0 missing
BLTD48numeric70 unique values
0 missing
BLTF96numeric71 unique values
0 missing
Br.094numeric2 unique values
0 missing
C.numeric69 unique values
0 missing
C.001numeric5 unique values
0 missing
C.002numeric8 unique values
0 missing
C.003numeric2 unique values
0 missing
C.004numeric2 unique values
0 missing
C.005numeric5 unique values
0 missing
C.006numeric10 unique values
0 missing
C.007numeric2 unique values
0 missing
C.008numeric4 unique values
0 missing
C.009numeric3 unique values
0 missing
C.011numeric2 unique values
0 missing
C.012numeric2 unique values
0 missing
C.013numeric3 unique values
0 missing
C.015numeric2 unique values
0 missing
C.016numeric4 unique values
0 missing
C.017numeric3 unique values
0 missing
C.019numeric2 unique values
0 missing
C.021numeric2 unique values
0 missing
C.022numeric3 unique values
0 missing
C.024numeric14 unique values
0 missing
C.025numeric8 unique values
0 missing
C.026numeric8 unique values
0 missing
C.027numeric4 unique values
0 missing
C.028numeric4 unique values
0 missing
C.029numeric4 unique values
0 missing
C.030numeric2 unique values
0 missing
C.031numeric2 unique values
0 missing
C.032numeric2 unique values
0 missing
C.033numeric3 unique values
0 missing
C.034numeric5 unique values
0 missing
C.035numeric2 unique values
0 missing
C.039numeric2 unique values
0 missing
C.040numeric4 unique values
0 missing
C.041numeric2 unique values
0 missing
C.042numeric2 unique values
0 missing
C.043numeric2 unique values
0 missing
C.044numeric2 unique values
0 missing
CATS2D_00_DDnumeric3 unique values
0 missing
CATS2D_00_DPnumeric3 unique values
0 missing
CATS2D_00_PPnumeric3 unique values
0 missing
CATS2D_01_AAnumeric4 unique values
0 missing
CATS2D_01_ANnumeric2 unique values
0 missing
CATS2D_01_DAnumeric2 unique values
0 missing
CATS2D_01_DNnumeric2 unique values
0 missing
CATS2D_01_LLnumeric16 unique values
0 missing
CATS2D_01_NLnumeric2 unique values
0 missing
CATS2D_02_AAnumeric6 unique values
0 missing
CATS2D_02_ALnumeric14 unique values
0 missing
CATS2D_02_APnumeric5 unique values
0 missing
CATS2D_02_DAnumeric7 unique values
0 missing
CATS2D_02_DDnumeric2 unique values
0 missing
CATS2D_02_DLnumeric9 unique values
0 missing
CATS2D_02_LLnumeric17 unique values
0 missing
CATS2D_02_NLnumeric2 unique values
0 missing
CATS2D_02_PLnumeric3 unique values
0 missing
CATS2D_03_AAnumeric6 unique values
0 missing
CATS2D_03_ALnumeric14 unique values
0 missing
CATS2D_03_APnumeric3 unique values
0 missing
CATS2D_03_DAnumeric4 unique values
0 missing
CATS2D_03_DDnumeric2 unique values
0 missing
CATS2D_03_DLnumeric9 unique values
0 missing
CATS2D_03_DPnumeric2 unique values
0 missing
CATS2D_03_LLnumeric17 unique values
0 missing
CATS2D_03_NLnumeric2 unique values
0 missing
CATS2D_03_PLnumeric3 unique values
0 missing
CATS2D_04_AAnumeric6 unique values
0 missing
CATS2D_04_ALnumeric16 unique values
0 missing
CATS2D_04_APnumeric4 unique values
0 missing
CATS2D_04_DAnumeric5 unique values
0 missing
CATS2D_04_DDnumeric5 unique values
0 missing
CATS2D_04_DLnumeric10 unique values
0 missing
CATS2D_04_DPnumeric3 unique values
0 missing
CATS2D_04_LLnumeric17 unique values
0 missing
CATS2D_04_PLnumeric4 unique values
0 missing
CATS2D_04_PPnumeric2 unique values
0 missing
CATS2D_05_AAnumeric7 unique values
0 missing
CATS2D_05_ALnumeric17 unique values
0 missing
CATS2D_05_APnumeric2 unique values
0 missing
CATS2D_05_DAnumeric5 unique values
0 missing
CATS2D_05_DDnumeric3 unique values
0 missing
CATS2D_05_DLnumeric9 unique values
0 missing
CATS2D_05_DNnumeric2 unique values
0 missing
CATS2D_05_DPnumeric2 unique values
0 missing
CATS2D_05_LLnumeric18 unique values
0 missing
CATS2D_05_PLnumeric4 unique values
0 missing
CATS2D_06_AAnumeric6 unique values
0 missing
CATS2D_06_ALnumeric15 unique values
0 missing
CATS2D_06_APnumeric3 unique values
0 missing
CATS2D_06_DAnumeric5 unique values
0 missing
CATS2D_06_DDnumeric2 unique values
0 missing
CATS2D_06_DLnumeric12 unique values
0 missing
CATS2D_06_DPnumeric2 unique values
0 missing
CATS2D_06_LLnumeric19 unique values
0 missing
CATS2D_06_PLnumeric5 unique values
0 missing
CATS2D_07_AAnumeric7 unique values
0 missing
CATS2D_07_ALnumeric16 unique values
0 missing
CATS2D_07_ANnumeric2 unique values
0 missing
CATS2D_07_APnumeric3 unique values
0 missing
CATS2D_07_DAnumeric5 unique values
0 missing
CATS2D_07_DDnumeric2 unique values
0 missing
CATS2D_07_DLnumeric11 unique values
0 missing
CATS2D_07_DPnumeric2 unique values
0 missing
CATS2D_07_LLnumeric17 unique values
0 missing
CATS2D_07_PLnumeric5 unique values
0 missing
CATS2D_08_AAnumeric5 unique values
0 missing
CATS2D_08_ALnumeric13 unique values
0 missing
CATS2D_08_APnumeric3 unique values
0 missing
CATS2D_08_DAnumeric6 unique values
0 missing
CATS2D_08_DDnumeric3 unique values
0 missing
CATS2D_08_DLnumeric7 unique values
0 missing
CATS2D_08_DPnumeric2 unique values
0 missing
CATS2D_08_LLnumeric15 unique values
0 missing
CATS2D_08_PLnumeric6 unique values
0 missing
CATS2D_09_AAnumeric4 unique values
0 missing
CATS2D_09_ALnumeric13 unique values
0 missing
CATS2D_09_APnumeric2 unique values
0 missing
CATS2D_09_DAnumeric5 unique values
0 missing
CATS2D_09_DDnumeric3 unique values
0 missing
CATS2D_09_DLnumeric7 unique values
0 missing
CATS2D_09_DPnumeric3 unique values
0 missing
CATS2D_09_LLnumeric13 unique values
0 missing
CATS2D_09_NLnumeric2 unique values
0 missing
CATS2D_09_PLnumeric4 unique values
0 missing
CENTnumeric83 unique values
0 missing
Chi0_AEA.bo.numeric84 unique values
0 missing
Chi0_AEA.dm.numeric84 unique values
0 missing
Chi0_AEA.ed.numeric84 unique values
0 missing
Chi0_AEA.ri.numeric84 unique values
0 missing
Chi0_EAnumeric84 unique values
0 missing
Chi0_EA.bo.numeric84 unique values
0 missing
Chi0_EA.dm.numeric83 unique values
0 missing
Chi0_EA.ed.numeric84 unique values
0 missing
Chi0_EA.ri.numeric84 unique values
0 missing
Chi1_AEA.bo.numeric83 unique values
0 missing
Chi1_AEA.dm.numeric83 unique values
0 missing
Chi1_AEA.ed.numeric83 unique values
0 missing
Chi1_AEA.ri.numeric83 unique values
0 missing
Chi1_EAnumeric83 unique values
0 missing
Show first 100 features

62 properties

NumberOfInstances
84
Number of instances (rows) of the dataset.
NumberOfFeatures
327
Number of attributes (columns) of the dataset.
NumberOfClasses
0
Number of distinct values of the target attribute (if it is nominal).
NumberOfMissingValues
0
Number of missing values in the dataset.
NumberOfInstancesWithMissingValues
0
Number of instances with at least one value missing.
NumberOfNumericFeatures
326
Number of numeric attributes.
NumberOfSymbolicFeatures
1
Number of nominal attributes.
MeanKurtosisOfNumericAtts
7.49
Mean kurtosis among attributes of the numeric type.
NumberOfBinaryFeatures
0
Number of binary attributes.
Quartile1MutualInformation
First quartile of mutual information between the nominal attributes and the target attribute.
MeanMeansOfNumericAtts
18.24
Mean of means among attributes of the numeric type.
Quartile1SkewnessOfNumericAtts
0.29
First quartile of skewness among attributes of the numeric type.
MeanMutualInformation
Average mutual information between the nominal attributes and the target attribute.
Quartile1StdDevOfNumericAtts
0.25
First quartile of standard deviation of attributes of the numeric type.
AutoCorrelation
0.41
Average class difference between consecutive instances.
MeanNoiseToSignalRatio
An estimate of the amount of irrelevant information in the attributes regarding the class. Equals (MeanAttributeEntropy - MeanMutualInformation) divided by MeanMutualInformation.
Quartile2AttributeEntropy
Second quartile (Median) of entropy among attributes.
ClassEntropy
Entropy of the target attribute values.
MeanNominalAttDistinctValues
Average number of distinct values among the attributes of the nominal type.
Quartile2KurtosisOfNumericAtts
0.42
Second quartile (Median) of kurtosis among attributes of the numeric type.
Dimensionality
3.89
Number of attributes divided by the number of instances.
MeanSkewnessOfNumericAtts
1.55
Mean skewness among attributes of the numeric type.
Quartile2MeansOfNumericAtts
3.32
Second quartile (Median) of means among attributes of the numeric type.
EquivalentNumberOfAtts
Number of attributes needed to optimally describe the class (under the assumption of independence among attributes). Equals ClassEntropy divided by MeanMutualInformation.
MeanStdDevOfNumericAtts
9.02
Mean standard deviation of attributes of the numeric type.
Quartile2MutualInformation
Second quartile (Median) of mutual information between the nominal attributes and the target attribute.
MajorityClassPercentage
Percentage of instances belonging to the most frequent class.
MinAttributeEntropy
Minimal entropy among attributes.
Quartile2SkewnessOfNumericAtts
0.82
Second quartile (Median) of skewness among attributes of the numeric type.
MajorityClassSize
Number of instances belonging to the most frequent class.
MaxAttributeEntropy
Maximum entropy among attributes.
MinKurtosisOfNumericAtts
-2.01
Minimum kurtosis among attributes of the numeric type.
PercentageOfBinaryFeatures
0
Percentage of binary attributes.
Quartile2StdDevOfNumericAtts
0.43
Second quartile (Median) of standard deviation of attributes of the numeric type.
MaxKurtosisOfNumericAtts
84
Maximum kurtosis among attributes of the numeric type.
MinMeansOfNumericAtts
-4.08
Minimum of means among attributes of the numeric type.
PercentageOfInstancesWithMissingValues
0
Percentage of instances having missing values.
Quartile3AttributeEntropy
Third quartile of entropy among attributes.
MaxMeansOfNumericAtts
1926.85
Maximum of means among attributes of the numeric type.
MinMutualInformation
Minimal mutual information between the nominal attributes and the target attribute.
PercentageOfMissingValues
0
Percentage of missing values.
Quartile3KurtosisOfNumericAtts
4.26
Third quartile of kurtosis among attributes of the numeric type.
MaxMutualInformation
Maximum mutual information between the nominal attributes and the target attribute.
MinNominalAttDistinctValues
The minimal number of distinct values among attributes of the nominal type.
PercentageOfNumericFeatures
99.69
Percentage of numeric attributes.
Quartile3MeansOfNumericAtts
6.06
Third quartile of means among attributes of the numeric type.
MaxNominalAttDistinctValues
The maximum number of distinct values among attributes of the nominal type.
MinSkewnessOfNumericAtts
-9.17
Minimum skewness among attributes of the numeric type.
PercentageOfSymbolicFeatures
0.31
Percentage of nominal attributes.
Quartile3MutualInformation
Third quartile of mutual information between the nominal attributes and the target attribute.
MaxSkewnessOfNumericAtts
9.17
Maximum skewness among attributes of the numeric type.
MinStdDevOfNumericAtts
0.03
Minimum standard deviation of attributes of the numeric type.
Quartile1AttributeEntropy
First quartile of entropy among attributes.
Quartile3SkewnessOfNumericAtts
1.85
Third quartile of skewness among attributes of the numeric type.
MaxStdDevOfNumericAtts
1009.3
Maximum standard deviation of attributes of the numeric type.
MinorityClassPercentage
Percentage of instances belonging to the least frequent class.
Quartile1KurtosisOfNumericAtts
-0.34
First quartile of kurtosis among attributes of the numeric type.
Quartile3StdDevOfNumericAtts
2.9
Third quartile of standard deviation of attributes of the numeric type.
MeanAttributeEntropy
Average entropy of the attributes.
MinorityClassSize
Number of instances belonging to the least frequent class.
Quartile1MeansOfNumericAtts
0.51
First quartile of means among attributes of the numeric type.
StdvNominalAttDistinctValues
Standard deviation of the number of distinct values among attributes of the nominal type.
Show all 62 properties

12 tasks

Supervised Regression on QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310
2 runs - estimation_procedure: Custom 10-fold Crossvalidation - target_feature: pXC50
Clustering on QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310
0 runs - estimation_procedure: 50 times Clustering
Clustering on QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310
0 runs - estimation_procedure: 50 times Clustering
Clustering on QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310
0 runs - estimation_procedure: 50 times Clustering
Clustering on QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310
0 runs - estimation_procedure: 50 times Clustering
Clustering on QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310
0 runs - estimation_procedure: 50 times Clustering
Clustering on QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310
0 runs - estimation_procedure: 50 times Clustering
Clustering on QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310
0 runs - estimation_procedure: 50 times Clustering
Clustering on QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310
0 runs
Clustering on QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310
0 runs - estimation_procedure: 50 times Clustering
Clustering on QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310
0 runs - estimation_procedure: 50 times Clustering
Clustering on QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL5310
0 runs - estimation_procedure: 50 times Clustering
Define a new task