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Changeset [3f52dd9c9a564346ae923fc64bfa7fd910b2d3d0] by timvdm

Revision 3f52dd9c9a564346ae923fc64bfa7fd910b2d3d0, committed by timvdm · June 10th, 2010 @ 01:46 PM

Change Molecule.findBond implementation to make use of the bonds stored in atoms. For structure 11 (mol_demo), this reduces the time needed for the SSSR calculation from 40s to 11s here.
http://github.com/kemia/kemia/commit/3f52dd9c9a564346ae923fc64bfa7f...

1 changed file

  • M jchemhub/model/molecule.js