ideaconsult/cdk

Issues

• final steps

  #22 opened 2 years ago by uli-f
  9

• @Ignored some test cases

  #16 opened 2 years ago by uli-f
  13

• RInChIGenerator::generateRinchiFromReaction issue with agents in CDK's MDLRXNWriter

  #17 opened 2 years ago by uli-f
  7

• fail early in RInChIGeneratorFactory when there is an issue with the native RInChI lib?

  #19 opened 2 years ago by uli-f
  3

• javadoc for method RInChIGeneratorFactory#getRInChIGenerator(reaction,string)

  #13 opened 2 years ago by uli-f
  1

• open TODO in RInChIToReaction

  #9 opened 2 years ago by uli-f
  3

• open TODO in RinchiGenerator

  #6 opened 2 years ago by uli-f
  7

• RInChIToReaction::configureMolecules cannot be changed

  #8 opened 2 years ago by uli-f
  1

• add logging messages in RinchiGenerator

  #5 opened 2 years ago by uli-f
  1

• Splitting the Factory (or alternatively just renaming it)

  #14 opened 2 years ago by uli-f
  2