Hi Max,
Try adding " --source=file_dcd " to your ConvertDataToHDF command.
-Alex
Search found 3 matches
- Fri May 04, 2012 2:24 pm
- Forum: MSMBuilder
- Topic: Failed in read in DCD by the latest MSMBuilder
- Replies: 5
- Views: 1650
- Fri Apr 13, 2012 6:15 am
- Forum: MSMBuilder
- Topic: Convert .lh5 trajectory files to readable format?
- Replies: 3
- Views: 1108
Re: Convert .lh5 trajectory files to readable format?
Thanks Josh! This works wonderfully. I find using python/numpy is usually the easiest way to go to avoid working with a bunch of different languages/formats in my analysis workflow. I'd believe it. And I know I should learn python one day, but I'm happy that today is not that day ;) Thanks again.. A...
- Thu Apr 12, 2012 8:19 am
- Forum: MSMBuilder
- Topic: Convert .lh5 trajectory files to readable format?
- Replies: 3
- Views: 1108
Convert .lh5 trajectory files to readable format?
Hi, I'm using MSMBuilder2.0 (and enjoying it very much so far :D), and I am trying to develop an external program that uses the output of the files in the "Trajectory" folder (EDIT: this is actually in Data/Assignments.h5), which show the sequence of states visited along each trajectory (if I rememb...