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README.md
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# DUD-E Docked Poses (gnina virtual screening)
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Pittsburgh
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**Original download:** <https://bits.csb.pitt.edu/files/gninavs/dude_vs.tgz>
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# DUD-E Docked Poses (gnina virtual screening)
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The docked poses from `dude_vs.tgz`, produced by the Koes lab at the University
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of Pittsburgh for *Virtual Screening with Gnina 1.0*.
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The original is one 14.7 GB archive that must be read start to finish. Here it is
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split by target into `dude-vs/`, one archive per DUD-E target, so you can download
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only the targets you need:
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```bash
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hf download Kingldore/dude-vs dude-vs/cdk2.tgz --repo-type dataset
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tar -xzf dude-vs/cdk2.tgz
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```
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102 targets, 4,363 files, 14.7 GB in total. The contents are unchanged from the
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original; only the packaging differs.
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**Original download:** <https://bits.csb.pitt.edu/files/gninavs/dude_vs.tgz>
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