Contents:
comp_chem_utils
comp_chem_utils.amino_acids
comp_chem_utils.conversions
comp_chem_utils.cpmd_utils
comp_chem_utils.molecule_data
comp_chem_utils.mts_md_turbo
comp_chem_utils.mysql_tables
comp_chem_utils.pdbfile
comp_chem_utils.periodic
comp_chem_utils.physcon
comp_chem_utils.program_info
comp_chem_utils.qmmm_utils
comp_chem_utils.read_gaussian
comp_chem_utils.sbatch_info
comp_chem_utils.spectrum
comp_chem_utils.utils
cpmd_scripts
cpmd_scripts.cell_size
cpmd_scripts.cpmd_spec
cpmd_scripts.get_cp_group
cpmd_scripts.read_orbs_info
cpmd_scripts.vmd_plot_cube
PDOS
PDOS.PDOS_module