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Chemical Data Processing Library Python API - Version 1.4.0
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Provides constants for the identification of RECAP fragmentation rules. More...
Inheritance diagram for CDPL.Chem.RECAPRuleID:Static Public Attributes | |
| int | NONE = 0 |
| Specifies that no RECAP rule matched the bond. | |
| int | AMIDE = 1 |
| Specifies the RECAP rule for amide bond cleavage. | |
| int | ESTER = 2 |
| Specifies the RECAP rule for ester bond cleavage. | |
| int | AMINE = 3 |
| Specifies the RECAP rule for amine bond cleavage. | |
| int | UREA = 4 |
| Specifies the RECAP rule for urea bond cleavage. | |
| int | ETHER = 5 |
| Specifies the RECAP rule for ether bond cleavage. | |
| int | OLEFIN = 6 |
| Specifies the RECAP rule for olefinic-bond cleavage. | |
| int | QUARTERNARY_N = 7 |
| Specifies the RECAP rule for quaternary-nitrogen bond cleavage. | |
| int | AROMATIC_N_ALIPHATIC_C = 8 |
| Specifies the RECAP rule for aromatic-N to aliphatic-C bond cleavage. | |
| int | LACTAM_N_ALIPHATIC_C = 9 |
| Specifies the RECAP rule for lactam-N to aliphatic-C bond cleavage. | |
| int | AROMATIC_C_AROMATIC_C = 10 |
| Specifies the RECAP rule for aromatic-C to aromatic-C bond cleavage (biaryl). | |
| int | SULFONAMIDE = 11 |
| Specifies the RECAP rule for sulfonamide bond cleavage. | |
Provides constants for the identification of RECAP fragmentation rules.