Limits with modeling data and modeling data with limits
Modeling of the solubility of amino acids and purine and pyrimidine bases with a set of sixteen molecular descriptors has been thoroughly analyzed to detect and understand the reasons for anomalies in the description of this property for these two classes of compounds. Unsatisfactory modeling can be...
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Format: | Article |
Language: | English |
Published: |
Ubiquity Press
2006-01-01
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Series: | Data Science Journal |
Subjects: | |
Online Access: | http://datascience.codata.org/articles/186 |