Published February 21, 2021 | Version v1
Dataset Open

CheckMyBlob web server ligand datasets

  • 1. Institute of Computing Science, Poznan University of Technology, Poznan, 60-965, Poland
  • 2. Department of Molecular Physiology and Biological Physics, University of Virginia, Charlottesville, VA 22908, USA
  • 3. Center for Biocrystallographic Research, Institute of Bioorganic Chemistry, Polish Academy of Sciences, Poznan, 61-704, Poland
  • 4. Faculty of Chemistry, Biological and Chemical Research Center, University of Warsaw, 02-089, Warsaw, Poland

Description

Ligand data set used to train and evaluate the CheckMyBlob web server, as described in "Recognizing and validating ligands with CheckMyBlob" by Brzezinski, D. et al.

Files

cmb_server_with_rare.csv

Files (452.5 MB)

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md5:faea9aeb1c646ad7847eb13bb34acebe
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md5:b22a03443df523937f3a6e80a69e831d
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