Ubuntu

Binary package “libchemistry-opensmiles-perl” in ubuntu noble

  1. Noble (24.04)
  2. libchemistry-opensmiles-perl

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.

Source package