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Published in 2022 at "ACS Omega"
DOI: 10.1021/acsomega.2c02554
Abstract: Recently, the Ramprasad group reported a quantitative structure–property relationship (QSPR) model for predicting the Egap values of 4209 polymers, which yielded a test set R2 score of 0.90 and a test set root-mean-square error (RMSE)…
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Keywords:
stacked generalization;
lgb stack;
model;
test ... See more keywords