Open ghutchis opened 6 years ago
There are a wide range of "cube" or volumetric data formats. The APBS support includes code for an OpenDX reader: https://github.com/OpenChemistry/avogadrolibs/blob/master/avogadro/qtplugins/apbs/opendxreader.h
It would be good to generalize this to allow other plugins (esp. in Python) for parsing other data types and formats (see, e.g. https://www.mdanalysis.org/GridDataFormats/gridData/formats.html)
There should then be a way to add / import cube data, e.g. in the surfaces extension.
See https://gemmi.readthedocs.io/en/latest/grid.html
ghutchis
commented
12 months ago
There are a wide range of "cube" or volumetric data formats. The APBS support includes code for an OpenDX reader: https://github.com/OpenChemistry/avogadrolibs/blob/master/avogadro/qtplugins/apbs/opendxreader.h
It would be good to generalize this to allow other plugins (esp. in Python) for parsing other data types and formats (see, e.g. https://www.mdanalysis.org/GridDataFormats/gridData/formats.html)
There should then be a way to add / import cube data, e.g. in the surfaces extension.