Quoting Anirban Ghosh <[EMAIL PROTECTED]>: > 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
Use tpbconv with the -time option to select a complete frame. -Justin > ------------------------------------------------------- > 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 > > > --------------------------------- > Download prohibited? No problem. CHAT from any browser, without download. ======================================== Justin A. Lemkul Graduate Research Assistant Department of Biochemistry Virginia Tech Blacksburg, VA [EMAIL PROTECTED] | (540) 231-9080 http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin/ ======================================== _______________________________________________ gmx-users mailing list [email protected] http://www.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to [EMAIL PROTECTED] Can't post? Read http://www.gromacs.org/mailing_lists/users.php
