Interface | Description |
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IAtomTypeGuesser |
Classes that implement this interface are atom type guessers.
|
IAtomTypeMatcher |
Classes that implement this interface are atom type matchers.
|
Class | Description |
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CDKAtomTypeMatcher |
Atom Type matcher that perceives atom types as defined in the CDK atom type list
org/openscience/cdk/dict/data/cdk-atom-types.owl . |
EStateAtomTypeMatcher |
Determines the EState atom types.
|
MM2AtomTypeMatcher | Deprecated
Incomplete and error prone - use at your own risk.
|
MMFF94AtomTypeMatcher | Deprecated
use the newer Mmff.assignAtomTypes()
|
StructGenAtomTypeGuesser |
AtomTypeMatcher that finds an AtomType by matching the Atom's element symbol.
|
StructGenMatcher |
AtomTypeMatcher that finds an AtomType by matching the Atom's element symbol.
|
SybylAtomTypeMatcher |
Atom Type matcher for Sybyl atom types.
|
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