With gmxcheck, I have the following:
*Checking file File1.trr* trn version: GMX_trn_file (single precision) Reading frame 0 time 10.000 # Atoms 47639 Last frame 12 time 14.800 Item #frames Timestep (ps) Step 13 0.4 Time 13 0.4 Lambda 13 0.4 Coords 13 0.4 Velocities 13 0.4 Forces 0 Box 13 0.4 *Checking file File2.trr* trn version: GMX_trn_file (single precision) Reading frame 0 time 15.000 # Atoms 47639 Last frame 12 time 19.800 Item #frames Timestep (ps) Step 13 0.4 Time 13 0.4 Lambda 13 0.4 Coords 13 0.4 Velocities 13 0.4 Forces 0 Box 13 0.4 *Checking file File3.trr* trn version: GMX_trn_file (single precision) Reading frame 0 time 20.000 # Atoms 47639 Last frame 12 time 24.800 Item #frames Timestep (ps) Step 13 0.4 Time 13 0.4 Lambda 13 0.4 Coords 13 0.4 Velocities 13 0.4 Forces 0 Box 13 0.4 *Checking file File4.trr* trn version: GMX_trn_file (single precision) Reading frame 0 time 25.000 # Atoms 47639 Last frame 12 time 29.800 Item #frames Timestep (ps) Step 13 0.4 Time 13 0.4 Lambda 13 0.4 Coords 13 0.4 Velocities 13 0.4 Forces 0 Box 13 0.4 *Checking file File5.trr* trn version: GMX_trn_file (single precision) Reading frame 0 time 30.000 # Atoms 47639 Reading frame 70 time 58.000 ------------------------------------------------------- Program gmxcheck, VERSION 4.0.7 Source code file: trnio.c, line: 66 File input/output error: Can not determine precision of trn file ------------------------------------------------------- This means that my FIle5.trr stopped at time 58.0000 (the correct would be 2000.0000)? IS THere any way to fix it? Thanks !
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