JChem 5.3 launched

news · 10 years ago

Major new features:

  • Structure Checker add-on, a tool for detecting molecule features or drawing errors
  • Pre-regeneration ability of JChem Tables
  • Homology groups supported on the query side
  • Support of Markush DARC - used by Thomson Reuters Merged Markush Service
  • Markush support in JChem Cartridge
  • Relational data handling inĀ JChem Web Services
  • Ajax example: Spreadsheet sorting by columns
  • Reactor: pre-filtering reactants speeds up enumeration
  • Sphere Exclusion and K-Means clustering methods in JKlustor

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History of changes