DatasetInteracting with GPCRs; on the use of Interaction Fingerprints for Virtual Screening.

?titleInteracting with GPCRs; on the use of Interaction Fingerprints for Virtual Screening.
?creatorLenselink, E.B. (Eelke)
?creatorJespers, W. (Willem)
?creatorvan Vlijmen, H.W.T. (Herman)
?creatorIJzerman, A.P. (Adriaan)
?creatorvan Westen, G.J.P. (Gerard)
?contributorLeiden Academic Centre for Drug Research
?date accepted2016-08-13
?date created2016
?date published2016
?description
The dataset contains results of experiments on five different GPCRs; 1) the docked poses of ligands and decoys. 2) the crystal structure of the protein that was used for the docking.
3) the co-crystalized ligand.
?languageen
?publisherLeiden University
?subjectDocking ● GPCRs ● Interaction Fingerprints ● Medicinal and Pharmaceutical Chemistry ● Virtual Screening
? ▲ in collection
DATA
+bag-info
+contents of this dataset, 15 files
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