X-Git-Url: http://biod.pnpi.spb.ru/gitweb/?a=blobdiff_plain;f=src%2Fgromacs%2Fgmxana%2Fnrama.cpp;fp=src%2Fgromacs%2Fgmxana%2Fnrama.c;h=04bfb5ba9a06d72dfd8e773a16f42c7840108f14;hb=8a9ed358b11c7181e46129f811c6f9a9805cbdd3;hp=165fb75b230750ea630dc639f0789ceab7754515;hpb=87823c5ebe2ecab05a07cfdfd5165e53cb07c30d;p=alexxy%2Fgromacs.git diff --git a/src/gromacs/gmxana/nrama.c b/src/gromacs/gmxana/nrama.cpp similarity index 99% rename from src/gromacs/gmxana/nrama.c rename to src/gromacs/gmxana/nrama.cpp index 165fb75b23..04bfb5ba9a 100644 --- a/src/gromacs/gmxana/nrama.c +++ b/src/gromacs/gmxana/nrama.cpp @@ -38,8 +38,7 @@ #include "nrama.h" -#include -#include +#include #include "gromacs/listed-forces/bonded.h" #include "gromacs/pbcutil/rmpbc.h" @@ -283,7 +282,6 @@ t_topology *init_rama(const output_env_t oenv, const char *infile, const char *topfile, t_xrama *xr, int mult) { t_topology *top; - int ePBC; real t; top = read_top(topfile, &xr->ePBC);