Index of /cvmfsmonitor/repository/facilities.gridpp.ac.uk/ccp4/release-7.0-updated/ccp4-7.0/share/RDKit/Contrib/mmpa/data
Name
Last modified
Size
Description
Parent Directory
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sample.smi
2018-04-05 16:35
412
sample_cansmirks.txt
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135
sample_db_input_smi.txt
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34
sample_db_input_subs..>
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12
sample_db_input_subs..>
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15
sample_db_input_tran..>
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32
sample_db_input_tran..>
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8
sample_db_search_smi..>
2018-04-05 16:35
103
sample_db_search_sub..>
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130
sample_db_search_sub..>
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1.5K
sample_db_search_tra..>
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121
sample_db_search_tra..>
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126
sample_fragmented.txt
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6.9K
sample_mmps_default.csv
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1.6K
sample_mmps_maxheavy..>
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272
sample_mmps_maxratio..>
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121
sample_mmps_sym.csv
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3.3K
sample_mmps_sym_maxh..>
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544
sample_mol_trans_out..>
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157
sample_smiles_mol_tr..>
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45
sample_smirks.txt
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138
sample_smirks_mol_tr..>
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25
sample_transfroms.txt
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84
simple.smi
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35