};
t_filenm fnm[] = {
- { efTPX, NULL, NULL, ffREAD },
+ { efTPR, NULL, NULL, ffREAD },
{ efTRX, "-f", NULL, ffREAD },
{ efNDX, NULL, NULL, ffOPTRD },
{ efXVG, "-o", "polystat", ffWRITE },
}
snew(top, 1);
- ePBC = read_tpx_top(ftp2fn(efTPX, NFILE, fnm),
+ ePBC = read_tpx_top(ftp2fn(efTPR, NFILE, fnm),
NULL, box, &natoms, NULL, NULL, NULL, top);
fprintf(stderr, "Select a group of polymer mainchain atoms:\n");