From ed74e5878cd19472a04bdcebb24199d6be831eff Mon Sep 17 00:00:00 2001 From: Axel Kohlmeyer Date: Mon, 23 Apr 2012 13:53:14 -0400 Subject: [PATCH] fix bug in initializing inp_name --- src/USER-COLVARS/fix_colvars.cpp | 6 ++++-- 1 file changed, 4 insertions(+), 2 deletions(-) diff --git a/src/USER-COLVARS/fix_colvars.cpp b/src/USER-COLVARS/fix_colvars.cpp index 738d1f7630..2ef1893b90 100644 --- a/src/USER-COLVARS/fix_colvars.cpp +++ b/src/USER-COLVARS/fix_colvars.cpp @@ -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();