MOESM3 of Can human experts predict solubility better than computers?
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Additional file 3. The name, structure and solubility data in electronic form for both training and test sets, including SMILES representations of the chemical structures. This DLS-100 dataset may be reused freely with appropriate citation of our work, no further permission is required. It is also available from the University of St Andrews research portal [14] with https://doi.org/10.17630/3a3a5abc-8458-4924-8e6c-b804347605e8 and from figshare [15] with https://doi.org/10.6084/m9.figshare.5545639 .
创建时间：
2017-12-14
