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rdkit 202503.6-3
  • links: PTS, VCS
  • area: main
  • in suites: forky, sid
  • size: 222,000 kB
  • sloc: cpp: 411,111; python: 78,482; ansic: 26,181; java: 8,285; javascript: 4,404; sql: 2,393; yacc: 1,626; lex: 1,267; cs: 1,090; makefile: 581; xml: 229; fortran: 183; sh: 121

Folder: data

d .. (parent)
- - rw-r--r-- 412 sample.smi
- - rw-r--r-- 135 sample_cansmirks.txt
- - rw-r--r-- 34 sample_db_input_smi.txt
- - rw-r--r-- 12 sample_db_input_subs.txt
- - rw-r--r-- 15 sample_db_input_subs_smarts.txt
- - rw-r--r-- 32 sample_db_input_trans.txt
- - rw-r--r-- 8 sample_db_input_trans_smarts.txt
- - rw-r--r-- 103 sample_db_search_smi_output.txt
- - rw-r--r-- 130 sample_db_search_subs_output.txt
- - rw-r--r-- 1,540 sample_db_search_subs_smart_output.txt
- - rw-r--r-- 121 sample_db_search_trans_output.txt
- - rw-r--r-- 126 sample_db_search_trans_smarts_output.txt
- - rw-r--r-- 7,101 sample_fragmented.txt
- - rw-r--r-- 1,684 sample_mmps_default.csv
- - rw-r--r-- 272 sample_mmps_maxheavy.csv
- - rw-r--r-- 121 sample_mmps_maxratio.csv
- - rw-r--r-- 3,368 sample_mmps_sym.csv
- - rw-r--r-- 544 sample_mmps_sym_maxheavy.csv
- - rw-r--r-- 157 sample_mol_trans_output.txt
- - rw-r--r-- 45 sample_smiles_mol_trans.smi
- - rw-r--r-- 138 sample_smirks.txt
- - rw-r--r-- 25 sample_smirks_mol_trans.txt
- - rw-r--r-- 84 sample_transfroms.txt
- - rw-r--r-- 35 simple.smi