temporarily working cmap ... bugged because cmap-type is always 0
Working CMAP (correct energies) + working bonded-cached (correct energies).
Working CMAP (correct energies) + working bonded-cached (correct energies). 2/2
found bug in non_bonded_cached
Fixed bug in non-bonded terms, all terms work with charmm22 parameters.
Updating to CHARMM36 parameters ... coulomb-term and torsion-term needs validation at this point
Fixed charges, impemented distance dependent di-electric constant, implemented e_psi term in term_torsion
Implemented EEF1-SB charges scheme
Fixed parsing of duplicate dihedral angles
Switched to EEF1-SB charges model and added E_psi correction to term_bonded_cached
Merge pull request #2 from andersx/master

Initial working version.