Hi All,
First thanks Xavier for your suggestion regarding trjconv. I am facing a
problem while extending the simulation for another 5 Nano seconds using the
command tpbconv. I am now getting the following error message:
Using frame of step 4785000 time 59800
Opened 417_30NS_2.edr as double precision energy file
Reading frame 490 time 59700.000
Last frame read 499
WARNING: Incomplete frame: nr 500 time 59790.000
-------------------------------------------------------
Program tpbconv_d, VERSION 3.3
Source code file: enxio.c, line: 395
Fatal error:
Could not find frame with time 59800.000455 in '417_30NS_2.edr'
-------------------------------------------------------
What should I do to rectify this problem and continue the simulation further?
Any suggestion is welcome. Thanks.
Cheers,
Anirban Ghosh
M.Tech Bioinformatics
University of Hyderabad
Project Trainee
Centre For DNA Fingerprinting & Diagnostics (CDFD)
Hyderabad
India
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