Toxtree (Toxic Hazard Estimation )

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Analyzed 4 months ago. based on code collected 7 months ago.

Commit Message	Contributor	Files Modified	Lines Added	Lines Removed	Code Location	Date
Jan 27, 2024 — Jan 27, 2025 Showing page 26 of 100 Search / Filter on:
Workaround for communicating with JCP	nina as vedina	More...				over 13 years ago
Workaround for communicating with JCP	nina as vedina	More...				over 13 years ago
Workaround for communicating with JCP	nina as vedina	More...				over 13 years ago
removed redundant classes	nina as vedina	More...				over 13 years ago
removed redundant classes	nina as vedina	More...				over 13 years ago
removed redundant classes	nina as vedina	More...				over 13 years ago
batch test updated	nina as vedina	More...				over 13 years ago
batch test updated	nina as vedina	More...				over 13 years ago
batch test updated	nina as vedina	More...				over 13 years ago
Code clean up. These classes are already defined in toxtree core, it is not reasonable to redefine them inside each plugin	nina as vedina	More...				over 13 years ago
Code clean up. These classes are already defined in toxtree core, it is not reasonable to redefine them inside each plugin	nina as vedina	More...				over 13 years ago
Code clean up. These classes are already defined in toxtree core, it is not reasonable to redefine them inside each plugin	nina as vedina	More...				over 13 years ago
Code cleanup	nina as vedina	More...				over 13 years ago
Code cleanup	nina as vedina	More...				over 13 years ago
Code cleanup	nina as vedina	More...				over 13 years ago
Fix for https://sourceforge.net/tracker/?func=detail&aid=3472325&group_id=152702&atid=785126 by switching to the Ambit isomorphism tester instead of CDK	nina as vedina	More...				over 13 years ago
Fix for https://sourceforge.net/tracker/?func=detail&aid=3472325&group_id=152702&atid=785126	nina as vedina	More...				over 13 years ago
Fix for https://sourceforge.net/tracker/?func=detail&aid=3472325&group_id=152702&atid=785126	nina as vedina	More...				over 13 years ago
Java doc updated	nina as vedina	More...				over 13 years ago
Java doc updated	nina as vedina	More...				over 13 years ago
Java doc updated	nina as vedina	More...				over 13 years ago
Protoheme structure updated https://sourceforge.net/tracker/?func=detail&aid=3431053&group_id=152702&atid=785126	nina as vedina	More...				over 13 years ago
Protoheme structure updated	nina as vedina	More...				over 13 years ago
Protoheme structure updated	nina as vedina	More...				over 13 years ago
removed duplicate classes from cramer2 tree. Cramer2 tree configured to use classes from the original Cramer rule, where possible.	nina as vedina	More...				over 13 years ago
removed duplicate classes from cramer2 tree.	nina as vedina	More...				over 13 years ago
removed duplicate classes from cramer2 tree.	nina as vedina	More...				over 13 years ago
Removed AtomContainerManipulator.percieveAtomTypesAndConfigureAtoms(mol) from RuleHasOtherThanC_H_O_N_S2. It is not necessary, as the atom types are configured before applying any tree rules. It is wrong to be run here, as it clears the aromaticity flags and subsequent rules fail. This should solve http://sourceforge.net/tracker/?func=detail&aid=3488950&group_id=152702&atid=785126	nina as vedina	More...				over 13 years ago
Removed AtomContainerManipulator.percieveAtomTypesAndConfigureAtoms(mol) from RuleHasOtherThanC_H_O_N_S2.	nina as vedina	More...				over 13 years ago
Removed AtomContainerManipulator.percieveAtomTypesAndConfigureAtoms(mol) from RuleHasOtherThanC_H_O_N_S2.	nina as vedina	More...				over 13 years ago

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