Merge branch 'release-2023' into release-2024

HITS-MCM · Mar 6, 2024 · 2e91aea · 2e91aea
2 parents 7ca4b48 + d7fe214
commit 2e91aea
Showing 1 changed file with 2 additions and 2 deletions.
diff --git a/src/gromacs/ramd/ramd.cpp b/src/gromacs/ramd/ramd.cpp
@@ -213,7 +213,7 @@ void RAMD::calculateForces(const ForceProviderInput& forceProviderInput,
 
     if (step % params.eval_freq == 0)
     {
-        if (MASTER(cr) and out)
+        if (MAIN(cr) and out)
         {
             fprintf(out, "\n");
             fflush(out);
@@ -222,7 +222,7 @@ void RAMD::calculateForces(const ForceProviderInput& forceProviderInput,
         // Exit if all ligand-receptor COM distances are larger than max_dist
         if (std::accumulate(ligand_exited.begin(), ligand_exited.end(), 0) == params.ngroup)
         {
-            if (MASTER(cr))
+            if (MAIN(cr))
             {
                 fprintf(this->log, "==== RAMD ==== GROMACS will be stopped after %ld steps.\n", step);
             }