Commit 327283ee authored by miaecle's avatar miaecle
Browse files

little fix

parent c167e96a
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+3 −3
Original line number Diff line number Diff line
@@ -203,7 +203,7 @@ passed a ``Featurizer`` object. DeepChem provides a number of
different subclasses of ``Featurizer`` for convenience:

### Performances
1. Index splitting
Index splitting
|Dataset    |N(tasks)	|N(samples) |Model               |Train score/ROC-AUC|Valid score/ROC-AUC|Time(loading)/s |Time(running)/s|
|-----------|-----------|-----------|--------------------|-------------------|-------------------|----------------|---------------| 
|tox21      |12         |8014       |logistic regression |0.910              |0.759              |30              |60             |
@@ -224,7 +224,7 @@ different subclasses of ``Featurizer`` for convenience:
|           |           |           |tensorflow(MT-NN)	 |0.926        	     |0.705              |80              |2300           |
|           |           |           |graph convolution   |0.906        	     |0.725              |80              |900            |

2. Random splitting(N(tasks), N(samples), Time omitted)
Random splitting(N(tasks), N(samples), Time omitted)
|Dataset    |Model               |Train score/ROC-AUC|Valid score/ROC-AUC|
|-----------|--------------------|-------------------|-------------------|
|tox21      |logistic regression |0.903              |0.741              |
@@ -248,7 +248,7 @@ different subclasses of ``Featurizer`` for convenience:
|           |robust MT-NN        |0.814              |0.692              |
|           |graph convolution   |0.820        	     |0.692              |

3. Scaffold splitting(N(tasks), N(samples), Time omitted)
Scaffold splitting(N(tasks), N(samples), Time omitted)
|Dataset    |Model               |Train score/ROC-AUC|Valid score/ROC-AUC|
|-----------|--------------------|-------------------|-------------------|
|tox21      |logistic regression |0.900              |0.650              |