Metadata-Version: 2.1
Name: genice_cif
Version: 0.2
Summary: CIF reader plugin for GenIce.
Home-page: https://github.com/vitroid/genice-cif/
Author: Masakazu Matsumoto
Author-email: vitroid@gmail.com
License: MIT
Description: # genice-cif
        
        A [GenIce](https://github.com/vitroid/GenIce) plugin to import CIF file.
        
        (version 0.2)
        
        ## Requirements
        
            % make prepare
        
        will install required packages via pip.
        
        * cif2ice
        * GenIce>=0.25
        
        ## Installation
        
        ### System-wide installation
        
        Install via pip.
        
            % pip install genice_cif
        
        ### Private installation
        
        Not supported.
        
        ## Usage
        
        * To convert a local cif file to Gromacs format,
        
        	% genice cif[RHO.cif] > RHO.gro
        
        * Some zeolites share the network topology with low-density ices. If you want to retrieve a zeolite ITT structure from [IZA structure database](http://www.iza-structure.org/databases) to prepare a low-density ice, try the following command:
        
        	% genice zeolite[ITT] > ITT.gro
        
        ## Test in place
        
            % make test
        
Keywords: genice,CIF
Platform: UNKNOWN
Classifier: Development Status :: 4 - Beta
Classifier: Intended Audience :: Developers
Classifier: Programming Language :: Python
Classifier: Programming Language :: Python :: 3.5
Description-Content-Type: text/markdown
