Chemistry/Mol version 0.11 ========================== This toolkit includes basic objects and methods to describe molecules. It consists of several modules: Chemistry::Mol, Chemistry::Atom, Chemistry::Bond, and Chemistry::File. The core methods try not to commit to a particular convention, therefore fields such as the bond type have no intrinsic meaning. Bonds are defined as a list of atoms (typically two) with an arbitrary type. Atoms are defined by a symbol and a Z, and may have 3D coordinates (2D and internal coming soon). CHANGES SINCE VERSION 0.10 - New methods for Chemistry::Mol: mass, formula, formula_hash - New methods for Chemistry::Atom: mass - New module: Chemistry::File::Formula INSTALLATION To install this module type the following: perl Makefile.PL make make test make install DEPENDENCIES This module requires these other modules and libraries: - Math::VectorReal COPYRIGHT AND LICENCE Copyright (C) 2003 Ivan Tubert This library is free software; you can redistribute it and/or modify it under the same terms as Perl itself.