X-Git-Url: http://biod.pnpi.spb.ru/gitweb/?a=blobdiff_plain;f=src%2Fgromacs%2Fgmxana%2Fgmx_h2order.c;h=27e918b8d3e700b1355356d31ec94e3249592440;hb=b2b75d45c43c98cf1362e0125381bfc6f0a85782;hp=314f20c46a91a28bec246b4848ce402840b025ee;hpb=cb466e44535ac45f2ee8341dcae39207b5813abe;p=alexxy%2Fgromacs.git diff --git a/src/gromacs/gmxana/gmx_h2order.c b/src/gromacs/gmxana/gmx_h2order.c index 314f20c46a..27e918b8d3 100644 --- a/src/gromacs/gmxana/gmx_h2order.c +++ b/src/gromacs/gmxana/gmx_h2order.c @@ -304,7 +304,7 @@ int gmx_h2order(int argc, char *argv[]) { efTRX, "-f", NULL, ffREAD }, /* trajectory file */ { efNDX, NULL, NULL, ffREAD }, /* index file */ { efNDX, "-nm", NULL, ffOPTRD }, /* index with micelle atoms */ - { efTPX, NULL, NULL, ffREAD }, /* topology file */ + { efTPR, NULL, NULL, ffREAD }, /* topology file */ { efXVG, "-o", "order", ffWRITE }, /* xvgr output file */ }; @@ -318,7 +318,7 @@ int gmx_h2order(int argc, char *argv[]) } bMicel = opt2bSet("-nm", NFILE, fnm); - top = read_top(ftp2fn(efTPX, NFILE, fnm), &ePBC); /* read topology file */ + top = read_top(ftp2fn(efTPR, NFILE, fnm), &ePBC); /* read topology file */ rd_index(ftp2fn(efNDX, NFILE, fnm), 1, &ngx, &index, &grpname);