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SAMPL6 logP challenge: machine learning and quantum mechanical approaches

Crossref DOI link: https://doi.org/10.1007/s10822-020-00287-0

Published Online: 2020-01-30

Published Print: 2020-05

Update policy: https://doi.org/10.1007/springer_crossmark_policy

Authors

Patel, Prajay

Kuntz, David M.

Jones, Michael R.

Brooks, Bernard R.

Wilson, Angela K. http://orcid.org/0000-0001-9500-1628
License Information

Text and Data Mining valid from 2020-01-30

Version of Record valid from 2020-01-30
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Article History

Received: 16 October 2019

Accepted: 8 January 2020

First Online: 30 January 2020