Artifacts using Ambit2 Core (25)
Workflow module contains classes, common for all workflows, used by AmbitXT plugins.
Last Release on Nov 13, 2012
Descriptors: pKA, functional groups, moleucle size, crossectional diameter, maximum diameter, molecular weight, spherosity, atom environment
CDK descriptors, listed at http://qsar.sourceforge.net/dicts/qsar-descriptors/index.xhtml are available via ambit2-core package.
Last Release on Nov 13, 2012
Chemical name to structure convertor, based on OPSIN package
http://sourceforge.net/projects/oscar3-chem/files/
Last Release on Nov 13, 2012
9. Ambit2 Mopac4 usages
ambit » ambit2-mopacLGPL
A wrapper for OpenMopac http://openmopac.net/
Last Release on Nov 13, 2012
10. Ambit2 SMARTS4 usages
ambit » ambit2-smartsLGPL
Implementation of a SMARTS parser.
Last Release on Nov 13, 2012