Benchmark sets for the optimization and evaluation of binding site comparison methodologies

Christiane Ehrt, Tobias Brinkjost, Oliver Koch

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Please select your download file (1), read and accept the license agreement (2), and click on download (3).

1. File Selection

kahraman_structures.tar.gz [6.7 MB]
identical_structures.tar.gz [17.2 MB]
identical_structures_similar_ligands.tar.gz [2.6 MB]
barelier_structures.tar.gz [22.8 MB]
decoy.tar.gz [327.6 MB]
review_structures.tar.gz [77.5 MB]
README.txt [916.0 B]
NMR_structures.tar.gz [16.9 MB]

2. License Agreement

I have read and accept the license agreement (EN, DE).