Rex branch

src/libraries/nSampling.jl

@@ -295,13 +295,13 @@ function merge_rates!(old,to_add)
         old[key][2] += to_add[key][2] 
     end
 end
-function run_NS(NS::NS,LJ::LennardJones.model)
+function run_NS(NS::NS,LJ::LennardJones.model, output_file)
 
     V = (NS.n_walkers - NS.n_cull + 1)/(NS.n_walkers + 1)
     cDir = pwd()
 
     i = 1
-    ns_io = open(joinpath(cDir,"NS.out"),"w")
+    ns_io = open(joinpath(cDir, output_file),"w")
     @printf(ns_io, "N_walkers = %6.2f\n",NS.n_walkers)
     @printf(ns_io, "N_cull = %4d\n",NS.n_cull)
     @printf(ns_io, "N_steps_per_walker = %6d\n", NS.n_iter)