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Published in 2021 at "Molecules"
DOI: 10.3390/molecules26041111
Abstract: Applied datasets can vary from a few hundred to thousands of samples in typical quantitative structure-activity/property (QSAR/QSPR) relationships and classification. However, the size of the datasets and the train/test split ratios can greatly affect the…
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Keywords:
classification;
split ratios;
train test;
test ... See more keywords