@article{e0f9e72e81e84422b165e2b2edd0ed74,
title = "High-Quality Dataset of Protein-Bound Ligand Conformations and Its Application to Benchmarking Conformer Ensemble Generators",
keywords = "3D CONFORMATION, CAMBRIDGE STRUCTURAL DATABASE, DATA-BANK, DISTANCE-GEOMETRY, DRUG DISCOVERY, ELECTRON-DENSITY, FORCE-FIELD, MOLECULAR-MECHANICS OPTIMIZATION, TEST SET, VALIDATION",
author = "Nils-Ole Friedrich and Agnes Meyder and Kops, \{Christina de Bruyn\} and Kai Sommer and Florian Flachsenberg and Matthias Rarey and Johannes Kirchmair",
note = "Publisher Copyright: {\textcopyright} 2017 American Chemical Society.",
year = "2017",
month = mar,
doi = "10.1021/acs.jcim.6b00613",
language = "English",
volume = "57",
pages = "529–539",
journal = "Journal of Chemical Information and Modeling",
issn = "1549-9596",
publisher = "AMER CHEMICAL SOC",
number = "3",
}