[Feature-dev] [ feature-Features-1248 ] PDB file preprocessing
noreply at simtk.org
noreply at simtk.org
Tue Jul 13 16:01:15 PDT 2010
Features item #1248, was opened at 2010-07-13 23:01
You can respond by visiting:
https://simtk.org/tracker/?func=detail&atid=148&aid=1248&group_id=16
Category: None
Group: None
Status: Open
Resolution: None
Priority: 3
Submitted By: Grace Tang (gwtang)
Assigned to: Nobody (None)
Summary: PDB file preprocessing
Initial Comment:
There is a lot of variation between PDB files. It may be helpful to include an initial preprocessing step that
1. Removes all Hydrogen atoms
2. Splits multi-model files into individual PDB files for analysis
----------------------------------------------------------------------
You can respond by visiting:
https://simtk.org/tracker/?func=detail&atid=148&aid=1248&group_id=16
More information about the Feature-dev
mailing list