Fixed shift and switch modifiers, particularly for free-energy

[alexxy/gromacs.git] / src / kernel / readir.c

diff --git a/src/kernel/readir.c b/src/kernel/readir.c
index 77ebe78672abdc998ec2ed8fff61574dd085036e..012d3312433226f92d610d5a5056f1f8bd72d2bc 100644 (file)
--- a/src/kernel/readir.c
+++ b/src/kernel/readir.c
@@ -1093,7 +1093,7 @@ void check_ir(const char *mdparin, t_inputrec *ir, t_gromppopts *opts,
         if (ir->rcoulomb_switch/ir->rcoulomb < 0.9499)
         {
             real percentage  = 100*(ir->rcoulomb-ir->rcoulomb_switch)/ir->rcoulomb;
-            sprintf(warn_buf, "The switching range for should be 5%% or less (currently %.2f%% using a switching range of %4f-%4f) for accurate electrostatic energies, energy conservation will be good regardless, since ewald_rtol = %g.",
+            sprintf(warn_buf, "The switching range should be 5%% or less (currently %.2f%% using a switching range of %4f-%4f) for accurate electrostatic energies, energy conservation will be good regardless, since ewald_rtol = %g.",
                     percentage,ir->rcoulomb_switch,ir->rcoulomb,ir->ewald_rtol);
             warning(wi, warn_buf);
         }