Table 1 MCS configuration
From: Reaction rebalancing: a novel approach to curating reaction databases
Configuration | 1 | 2 | 3 | 4 | 5 |
|---|---|---|---|---|---|
RingMatchesRingOnly | True | True | False | False | – |
CompleteRingsOnly | True | True | False | False | – |
Ignore Bond Order | True | False | True | False | – |
Algorithm | FMCS | FMCS | FMCS | FMCS | RASCAL |