Hello!
I've been running a simulation for a few picoseconds when the machine
crashed. The I tryied to use tpbconv, but it said that the .edr file is
empty and cannot generate the .tpr file. I suppose that it is due to
buffering issues that the .edr file was not written and the .trr file was
written.
Is there any way to quickly get an energy file for the trajectory that we
have without having to rerun all the simulation?
Thanks a lot!
--
Jordi Camps Puchades
[EMAIL PROTECTED]
Supercomputing research, support and development
Barcelona Supercomputing Center | Instituto Nacional de Bioinformática
| GNHC-2 UPC-CIRI
(http://inb.lsi.upc.edu)
http://www.bsc.es | http://www.inab.org
Tel. : 934 134 049 | Tel. : 934 037 155
Fax : 934 137 721 | Fax : 934 037 157
c/ Jordi Girona, 29 | c/ Josep Samitier, 1-5
Edifici Nexus II, despatx 109-112 | PCB, Edifici Modular, PBC32
E-08034 Barcelona | E-08028 Barcelona
Catalunya (Spain) | Catalunya (Spain)
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