HashGeneratorMaker |
HashGeneratorMaker.charged() |
Discriminate protonation states.
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HashGeneratorMaker |
HashGeneratorMaker.chiral() |
Generate different hash codes for stereoisomers.
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HashGeneratorMaker |
HashGeneratorMaker.depth(int depth) |
Specify the depth of the hash generator.
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HashGeneratorMaker |
HashGeneratorMaker.elemental() |
Discriminate elements.
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HashGeneratorMaker |
HashGeneratorMaker.encode(AtomEncoder encoder) |
Add a custom encoder to the hash generator which will be built.
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HashGeneratorMaker |
HashGeneratorMaker.isotopic() |
Discriminate isotopes.
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HashGeneratorMaker |
HashGeneratorMaker.orbital() |
Discriminate atomic orbitals.
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HashGeneratorMaker |
HashGeneratorMaker.perturbed() |
Discriminate atoms experiencing uniform environments.
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HashGeneratorMaker |
HashGeneratorMaker.radical() |
Discriminate free radicals.
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HashGeneratorMaker |
HashGeneratorMaker.suppressHydrogens() |
Suppress any explicit hydrogens in the encoding of hash values.
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