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Package joelib.algo.morgan
Provides classes for calculating Depth First Search (DFS) [] Breadth First Search (BFS) [] on molecular graphs.
See:
Description
| Interface Summary | |
| SingleTieResolver | Interface for resolving renumbering ties. |
| TieResolver | Interface for resolving renumbering ties. |
| Class Summary | |
| AtomDouble | Helper class for resolving renumbering ties. |
| AtomDoubleComparator | Comparator for resolving renumbering ties.. |
| AtomDoubleParent | Helper class for resolving renumbering ties. |
| Morgan | Morgan number generation and unique molecule numbering. |
| MorganTest | Unique molecule numbering test. |
Package joelib.algo.morgan Description
Provides classes for calculating Depth First Search (DFS) [] Breadth First Search (BFS) [] on molecular graphs. And additional algorithms, like Morgan's algorithm for the unique numbering of molecules are also available.
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| Home >> All >> joelib >> algo >> [ morgan overview ] | PREV PACKAGE NEXT PACKAGE | ||||||||