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Why	
  JChem	
  breaks	
  the	
  
sausage	
  principle	
  
Miklos	
  Vargyas	
  
"People who love sausage and
respect the law
should never watch either one
being made.”
Otto von Bismarck
speed up the tautomer
search in the database!
As a registrar at BIGPharma I
would like to be able to pre-
check if the structure to be
registered exists in the database inany tautomer form so that I can
avoid entering duplicates.!
Acceptance criteria!
 full fragment search !
 in reasonable time!
 using reasonable memory!
EUGM 2013 - Miklos Vargyas (ChemAxon) - Why JChem breaks the sausage principle
EUGM 2013 - Miklos Vargyas (ChemAxon) - Why JChem breaks the sausage principle
EUGM 2013 - Miklos Vargyas (ChemAxon) - Why JChem breaks the sausage principle
EUGM 2013 - Miklos Vargyas (ChemAxon) - Why JChem breaks the sausage principle
EUGM 2013 - Miklos Vargyas (ChemAxon) - Why JChem breaks the sausage principle
EUGM 2013 - Miklos Vargyas (ChemAxon) - Why JChem breaks the sausage principle

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EUGM 2013 - Miklos Vargyas (ChemAxon) - Why JChem breaks the sausage principle