dimchris / mdanalysis

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use the VMD mofile plugin #55

Open GoogleCodeExporter opened 9 years ago

GoogleCodeExporter commented 9 years ago
It would be good to use the VMD molfile plugin for file formats, for which we 
don't have a native reader.

http://www.ks.uiuc.edu/Research/vmd/plugins/molfile/

The user will have to install the plugin library (a shared lib) separately and 
MDAnalysis will dynamically link it.

Need to write or adapt a Python wrapper (which could be useful in its own right 
outside of MDA, too). Documentation for programmers at 
http://www.ks.uiuc.edu/Research/vmd/plugins/doxygen/ but I haven't found any 
open source Python code to access the library (suggestions are welcome!).

Original issue reported on code.google.com by orbeckst on 24 Dec 2010 at 1:52

GoogleCodeExporter commented 9 years ago
would be nice to have but not super-urgent, given that we have added Amber and 
pqr readers

Original comment by orbeckst on 5 Feb 2011 at 11:06

GoogleCodeExporter commented 9 years ago

Original comment by orbeckst on 22 Apr 2011 at 9:29

GoogleCodeExporter commented 9 years ago
[deleted comment]
GoogleCodeExporter commented 9 years ago
[deleted comment]
GoogleCodeExporter commented 9 years ago

Original comment by orbeckst on 13 Nov 2011 at 10:37

GoogleCodeExporter commented 9 years ago

Original comment by orbeckst on 15 Nov 2011 at 2:14