├── LICENSE ├── README.md ├── geodesic_interpolate ├── .DS_Store ├── __init__.py ├── __main__.py ├── coord_utils.py ├── fileio.py ├── geodesic.py └── interpolation.py ├── setup.py └── test_cases ├── 2JOF-pH7.pdb ├── DielsAlder.log ├── DielsAlder.xyz ├── DielsAlder_interpolated.xyz ├── H+CH4_CH3+H2.log ├── H+CH4_CH3+H2.xyz ├── H+CH4_CH3+H2_interpolated.xyz ├── TrpCage_interpolated.xyz ├── TrpCage_unfold.xyz ├── calcium_binding.log ├── calcium_binding.xyz ├── calcium_binding_interpolated.pdb ├── calcium_binding_interpolated.xyz ├── collagen.log ├── collagen.xyz ├── collagen_interpolated.xyz ├── interpolated.xyz ├── raw.xyz └── trp_unfold.log /LICENSE: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/virtualzx-nad/geodesic-interpolate/HEAD/LICENSE -------------------------------------------------------------------------------- /README.md: -------------------------------------------------------------------------------- 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