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p5-Chemistry-Canonicalize

0.11_1

Number the atoms in a molecule in a unique way

Perl module which provides functions for "canonicalizing" a molecular structure; that is, to number the atoms in a unique way regardless of the input order.

Origin: science/p5-Chemistry-Canonicalize
Category: science
Size: 18.7KiB
License: ART10, GPLv1+
Maintainer: perl@FreeBSD.org
Dependencies: 2 packages
Required by: 4 packages
Website: metacpan.org/release/Chemistry-Canonicalize
$pkg install p5-Chemistry-Canonicalize

Dependencies (2)

perl5p5-Chemistry-Mol

Required By (4 packages)

p5-Chemistry-File-SLNp5-Chemistry-File-SMILESp5-Chemistry-InternalCoordsp5-PerlMol

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