@article{248c7d8a8ea04d3ab3c27e1d328eddaf,
title = "GRAIL: GRids of phArmacophore Interaction fieLds",
keywords = "COMPUTATIONAL TOOL, DESIGN, DRUG DISCOVERY, FAVORABLE BINDING-SITES, HSP90, INHIBITORS, KINETICS, MOLECULAR-DYNAMICS, PROTEIN, SIMULATION",
author = "Schuetz, \{Doris Alexandra\} and Thomas Seidel and Arthur Garon and Riccardo Martini and Markus K{\"o}rbel and Ecker, \{Gerhard F\} and Thierry Langer",
note = "Publisher Copyright: {\textcopyright} 2018 American Chemical Society.",
year = "2018",
month = sep,
doi = "10.1021/acs.jctc.8b00495",
language = "English",
volume = "14",
pages = "4958–4970",
journal = "Journal of Chemical Theory and Computation",
issn = "1549-9618",
publisher = "AMER CHEMICAL SOC",
number = "9",
}