PerlMol version 0.2300 ====================== PerlMol is a collection of Perl modules for chemoinformatics and computational chemistry with the philosophy that "simple things should be simple". It should be possible to write one-liners that use this toolkit to do meaningful "molecular munging". The perlmol toolkit provides objects and methods for representing molecules, atoms, and bonds in Perl; doing substructure matching; and reading and writing files in various formats. This is a bundle containing all of the modules of the PerlMol Project and their dependencies. CONTENTS Math::VectorReal 1.02 Statistics-Regression 0.15 Chemistry::Mol 0.24 Chemistry::MacroMol 0.05 Chemistry::InternalCoords 0.11 Chemistry::Ring 0.11 Chemistry::Canonicalize 0.10 Chemistry::Bond::Find 0.21 Chemistry::File::MDLMol 0.15 Chemistry::File::SMILES 0.40 Chemistry::Pattern 0.21 Chemistry::File::PDB 0.15 Chemistry::File::Mopac 0.10 Chemistry::File::SMARTS 0.10 Chemistry::Mok 0.21 INSTALLATION To install this module type the following: perl Makefile.PL make make test make install DEPENDENCIES perl-5.6.0 or a more recent version. If you have perl-5.8.0 (or a more recent version), this bundle has everything you need. If you have an earlier version of Perl, you also need these core modules: Test::Simple 0.45 Scalar::Util 1.07 Storable 2.04 Text::Balanced 1.89 COPYRIGHT AND LICENSE Copyright (C) 2004 Ivan Tubert This library is free software; you can redistribute it and/or modify it under the same terms as Perl itself.