[ Bron: libchemistry-opensmiles-perl ]
Pakket: libchemistry-opensmiles-perl (0.4.3-2)
Verwijzigingen voor libchemistry-opensmiles-perl
Debian bronnen:
Het bronpakket libchemistry-opensmiles-perl downloaden:
- [libchemistry-opensmiles-perl_0.4.3-2.dsc]
- [libchemistry-opensmiles-perl_0.4.3.orig.tar.gz]
- [libchemistry-opensmiles-perl_0.4.3-2.debian.tar.xz]
Beheerders:
Externe bronnen:
- Homepage [metacpan.org]
Vergelijkbare pakketten:
OpenSMILES format reader and writer
Chemistry::OpenSMILES provides support for SMILES chemical identifiers conforming to OpenSMILES v1.0 specification.
Chemistry::OpenSMILES::Parser reads in SMILES strings and returns them parsed to arrays of Graph::Undirected objects. Each atom is represented by a hash.
Chemistry::OpenSMILES::Writer performs the inverse operation. Generated SMILES strings are by no means optimal.
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