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Tree [926107] cdk2.8-fixes / History
| File | Date | Author | Commit |
|---|---|---|---|
| .github | 2023-02-23 |
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[da90be] ops: bump repository-dispatch to v2 to fix GH a... |
| ambit2-all | 2023-12-06 |
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[926107] Added debug info for target stereo elements at ... |
| ambit2-apps | 2023-04-03 |
|
[72bf94] Added maven dependency commons-cli |
| .editorconfig | 2021-08-25 |
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[4404bf] editorconfig: add .prop files |
| .gitattributes | 2007-12-14 |
|
[f8df5f] |
| .gitignore | 2021-07-18 |
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[5ef7f8] Git: Update .gitignore |
| README.md | 2018-05-18 |
|
[83f839] README updates |
Read Me
AMBIT
AMBIT offers chemoinformatics functionality via OpenTox API compliant REST web services.
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Chemical structures, substances, nanomaterials and data storage in MySQL database;
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Substructure, similarity and other queries (The CDK; AMBIT SMARTS, SMIRKS, tautomers);
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Descriptor calculation and predictive models building (Weka, Toxtree).
Applications
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The LRI AMBIT Read across tool loaded with REACH dossiers
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applicability domain Ambit Discovery and more recent command line application
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More applications using AMBIT and examples how to call AMBIT modules at https://github.com/ideaconsult/apps-ambit