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denoptim-project / DENOPTIM

DENOPTIM is a software package for de novo design and virtual screening of functional molecules of any kind.
GNU Affero General Public License v3.0
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Sym vrtxs in same branch devel #133

Closed marcellocostamagna closed 3 months ago

marcellocostamagna commented 5 months ago

Resolves the issue of creating symmetric vertices in the same branches (which leads to errors in performing mutations) when the initial population is constructed by fragmentation.

marcellocostamagna commented 3 months ago

Need further modifications to the symmetry detection algorithm