Added missing argument to mol_noe_calc_peaks

ignatovmg · Apr 13, 2021 · f23d069 · f23d069
1 parent 84d97f0
commit f23d069
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/src/energy.c b/src/energy.c
@@ -145,7 +145,7 @@ lbfgsfloatval_t energy_func(
 
 #ifdef NOE
     if (energy_prm->nmr != NULL) {
-        mol_noe_calc_peaks(energy_prm->nmr->spec, energy_prm->ag, true);
+        mol_noe_calc_peaks(energy_prm->nmr->spec, energy_prm->ag, true, false);
         mol_noe_calc_energy(
                 energy_prm->nmr->spec,
                 energy_prm->ag->gradients,