Difference between revisions of "SMILES"

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  |extensions=smi
 
  |extensions=smi
 
  |mime=chemical/x-daylight-smiles
 
  |mime=chemical/x-daylight-smiles
  |url=http://www.daylight.com/smiles/f_smiles.html
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  |url=http://www.daylight.com/smiles/
  |notes=None
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  |import=Yes
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|export=Yes
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|version=All
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|dimensionality=0D
 
  |options=
 
  |options=
 
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Open Babel supports an extension to Daylight SMILES for [[Radicals and SMILES extensions|radicals]].
  
 
[[Category:Formats]]
 
[[Category:Formats]]

Latest revision as of 07:06, 22 February 2007

Filename Extensions smi
Chemical MIME Type chemical/x-daylight-smiles
Specification URL http://www.daylight.com/smiles/
Import Yes
Export Yes
Open Babel Version All

Options

             A linear text format which can describe the connectivity and chirality of a molecule
             Write Options e.g. -xt
             -n no molecule name
             -t molecule name only
             -r radicals lower case eg ethyl is Cc

Additional Comments

Open Babel supports an extension to Daylight SMILES for radicals.