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Atom Query Property

  • Checker searches for atoms having query properties. Tick options for searching:

    • Hydrogen Count (:hydrogenCount=true);
    • Connection Count (:connectionCount=true);
    • Ring Bond Count (:ringBondCount=true);
    • Ring Count (:ringCount=true);
    • Implicit Hydrogen Count (:implicitHydrogenCount=true);
    • Smallest Ring Size (:smallestRingSize=true);
    • Aromaticity (:aromaticity=true);
    • Substitution Count (:substitutionCount=true);
    • Unsaturation (:unsaturation=true);
    • Explicit Connection Count (:explicitConnectionCount=true)
    • Recursive SMARTS (:recursiveSmarts=true)
  • Fixer: removes the identified query properties (removeatomqueryproperty`).

Example :

Atom Query Property Checker (atomqueryproperty) Warning: Fix
Removing query property (removeatomqueryproperty)
Detect Atom Query Property images/download/attachments/1806469/ex_atomqp_ch.png example atom query property images/download/attachments/1806469/ex_atomqp_f.png fixed atom query property