--- old+++ new@@ -1,3 +1,4 @@+When I apply the skin irritation module , I receive the alert+`Q4 Group C (C,H,O) à Does the structure contain elements other than C,O. ` : Yes-When I apply the skin irritation module , I receive the alert Q4 à Group C (C,H,O) à Does the structure contain elements other than C,O. à Yes-CAS 100074-94-0 = CCOC(=O)CC(=O)OCC(=O)OCC+for CAS `100074-94-0` SMILES `CCOC(=O)CC(=O)OCC(=O)OCC`
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Diff:
The rule name is wrong. The rules Q4, Q33,Q9, Q19 are verifying if the structure has only these elements, according to the rules published in
This is fixed with commit https://sourceforge.net/p/toxtree/git/ci/c2b1b96ab8f43f8e1289f4ba8f4834838add3738/ and the correct naming will be included in the next release.