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annotate test-data/simsearch_on_tragets_and_q.tabular @ 11:2efd2a7c3015

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ChemicalToolBoX update.
author Bjoern Gruening <bjoern.gruening@gmail.com>
date Mon, 27 May 2013 17:00:09 +0200
parents b4cbee77896d
children 987b62da416d
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1 #Simsearch/1
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2 #num_bits=881
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3 #type=Tanimoto k=4 threshold=0.7
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4 #software=chemfp/1.0
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5 #queries=q.fps
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6 #targets=target.fps
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7 #query_sources=CID_28434379.sdf
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8 #target_sources=Desktop/3579363516810334491.sdf
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9 4 28434379 55091752 0.9684 55091466 0.9682 55091416 0.9682 55102353 0.9682