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Nevertheless, a single consolidated literature source on statistical spectrum occupancy prediction is not yet available in the open literature.
13321_2017_250_MOESM2_ESM.pdf Additional file 2. The names and structures of the 25 compounds in the test set, and a literature source for each solubility value.
The names and structures of 75 compounds in the training set, their solubilities, and a literature source for each solubility value.
The scattering factors marked by * in the table show estimated values, as these values were not recorded in the corresponding literature source.
Additional file 1 shows the names and structures of 75 compounds in the training set, their solubilities, and a literature source for the solubility; Additional file 2 does the same for the 25 test set molecules.
For each literature source, a curator manually constructed the 2D chemical structures using Marvin Sketch (v14.9.1.0) [44] and converted them into SMILES strings using JChem for Excel (v14.9.100.809) [44].
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It also provides free full-text access to 18,000 journals and literature sources.
Comparisons with several recent literature sources (experiments) show good agreement.
In the belief merging literature, sources of information are generally assumed to be equally reliable.
Most of the data in DrugBank is expertly curated from primary literature sources [31].
DrugBank data are curated by a curation team based on primary literature sources.
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Justyna Jupowicz-Kozak
CEO of Professional Science Editing for Scientists @ prosciediting.com