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cli24_KB
cli24_KB
 
 
cli24_out_tmpl_0
cli24_out_tmpl_0
 
 
cli24_out_tmpl_1
cli24_out_tmpl_1
 
 
cli24_out_tmpl_2
cli24_out_tmpl_2
 
 
cli34_data
cli34_data
 
 
cli36_wdir
cli36_wdir
 
 
cli40_out_tmpl_0
cli40_out_tmpl_0
 
 
cli40_out_tmpl_1
cli40_out_tmpl_1
 
 
cli40_out_tmpl_2
cli40_out_tmpl_2
 
 
cli41_KB
cli41_KB
 
 
cli41_out_tmpl_0
cli41_out_tmpl_0
 
 
cli41_out_tmpl_1
cli41_out_tmpl_1
 
 
cli41_out_tmpl_2
cli41_out_tmpl_2
 
 
cli42_KB
cli42_KB
 
 
cli42_out_tmpl_0
cli42_out_tmpl_0
 
 
cli42_out_tmpl_1
cli42_out_tmpl_1
 
 
cli43_KB
cli43_KB
 
 
cli43_out_tmpl_0
cli43_out_tmpl_0
 
 
cli43_out_tmpl_1
cli43_out_tmpl_1
 
 
cli44_KB
cli44_KB
 
 
cli44_out_tmpl_0
cli44_out_tmpl_0
 
 
cli44_out_tmpl_1
cli44_out_tmpl_1
 
 
cli47_KB
cli47_KB
 
 
cli47_out_tmpl_0
cli47_out_tmpl_0
 
 
cli47_out_tmpl_1
cli47_out_tmpl_1
 
 
cli47_out_tmpl_2
cli47_out_tmpl_2
 
 
cli48_KB
cli48_KB
 
 
cli48_out_tmpl_0
cli48_out_tmpl_0
 
 
cli48_out_tmpl_1
cli48_out_tmpl_1
 
 
cli48_out_tmpl_2
cli48_out_tmpl_2
 
 
cli48_out_tmpl_3
cli48_out_tmpl_3
 
 
cli48_out_tmpl_4
cli48_out_tmpl_4
 
 
cli49_data
cli49_data
 
 
data
data
 
 
t11_KB
t11_KB
 
 
t124_KB
t124_KB
 
 
t153.spardir
t153.spardir
 
 
t154-xtb
t154-xtb
 
 
t155-xtb
t155-xtb
 
 
t156-out.spardir
t156-out.spardir
 
 
t168_data
t168_data
 
 
t1_KB
t1_KB
 
 
t71.spartan
t71.spartan
 
 
t72.spartan
t72.spartan
 
 
t81.Conf.mol.spardir
t81.Conf.mol.spardir
 
 
t82-models
t82-models
 
 
cli0.check
cli0.check
 
 
cli0.sh
cli0.sh
 
 
cli1.check
cli1.check
 
 
cli1.sh
cli1.sh
 
 
cli10-mol.sdf
cli10-mol.sdf
 
 
cli10.check
cli10.check
 
 
cli10.sh
cli10.sh
 
 
cli11.check
cli11.check
 
 
cli11.sh
cli11.sh
 
 
cli12.check
cli12.check
 
 
cli12.sh
cli12.sh
 
 
cli12_log4j2.xml
cli12_log4j2.xml
 
 
cli13-mol.sdf
cli13-mol.sdf
 
 
cli13.check
cli13.check
 
 
cli13.json
cli13.json
 
 
cli13.sh
cli13.sh
 
 
cli14-mol.sdf
cli14-mol.sdf
 
 
cli14.check
cli14.check
 
 
cli14.params
cli14.params
 
 
cli14.sh
cli14.sh
 
 
cli15-a.json
cli15-a.json
 
 
cli15-mol.sdf
cli15-mol.sdf
 
 
cli15.check
cli15.check
 
 
cli15.sh
cli15.sh
 
 
cli16-g16.json
cli16-g16.json
 
 
cli16-mol.xyz
cli16-mol.xyz
 
 
cli16-ref.sdf
cli16-ref.sdf
 
 
cli16.check
cli16.check
 
 
cli16.json
cli16.json
 
 
cli16.sh
cli16.sh
 
 
cli17-crtMove
cli17-crtMove
 
 
cli17-mol.sdf
cli17-mol.sdf
 
 
cli17.check
cli17.check
 
 
cli17.sh
cli17.sh
 
 
cli18.check
cli18.check
 
 
cli18.par
cli18.par
 
 
cli18.sh
cli18.sh
 
 
cli19-mol.sdf
cli19-mol.sdf
 
 
cli19.check
cli19.check
 
 
cli19.json
cli19.json
 
 
cli19.sh
cli19.sh
 
 
cli2.check
cli2.check
 
 
cli2.sdf
cli2.sdf
 
 
cli2.sh
cli2.sh
 
 
cli20-mol.xyz
cli20-mol.xyz
 
 
cli20.check
cli20.check
 
 
cli20.sh
cli20.sh
 
 
cli21-mol.sdf
cli21-mol.sdf
 
 
cli21.check
cli21.check
 
 
cli21.sh
cli21.sh
 
 
cli22-mol.sdf
cli22-mol.sdf
 
 
cli22-xtb.out
cli22-xtb.out
 
 
cli22.check
cli22.check
 
 
cli22.json
cli22.json