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fix bug in initializing inp_name

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This commit is contained in:
Axel Kohlmeyer
2012-04-23 13:53:14 -04:00
parent 2e0a78eb82
commit ed74e5878c
1 changed files with 4 additions and 2 deletions
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6
src/USER-COLVARS/fix_colvars.cpp
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@ -479,9 +479,10 @@ void FixColvars::init()
if (me == 0) {
if (inp_name) {
if (strcmp(inp_name,"NULL") == 0)
if (strcmp(inp_name,"NULL") == 0) {
memory->sfree(inp_name);
inp_name = NULL;
inp_name = NULL;
}
}
double t_target = 0.0;
@ -495,6 +496,7 @@ void FixColvars::init()
if (tt) t_target = *tt;
}
}
proxy = new colvarproxy_lammps(lmp,conf_file,inp_name,out_name,
rng_seed,t_target,typemap);
coords = proxy->get_coords();