From 783d21c19b2b988c16a91dcadf294a885026c89a Mon Sep 17 00:00:00 2001
From: Axel Kohlmeyer <akohlmey@gmail.com>
Date: Tue, 14 Jan 2025 00:55:48 -0500
Subject: [PATCH] these functions do not create errors or throw exceptions

---
 src/library.cpp | 21 +++------------------
 1 file changed, 3 insertions(+), 18 deletions(-)

diff --git a/src/library.cpp b/src/library.cpp
index 71243611a2..17225fec40 100644
--- a/src/library.cpp
+++ b/src/library.cpp
@@ -2979,12 +2979,7 @@ double lammps_eval(void *handle, const char *expr)
  */
 void lammps_compute_clearstep(void * handle) {
   auto lmp = (LAMMPS *) handle;
-
-  BEGIN_CAPTURE
-  {
-    lmp->modify->clearstep_compute();
-  }
-  END_CAPTURE
+  lmp->modify->clearstep_compute();
 }
 
 /* ---------------------------------------------------------------------- */
@@ -3007,12 +3002,7 @@ void lammps_compute_clearstep(void * handle) {
  */
 void lammps_compute_addstep_all(void * handle, bigint newstep) {
   auto lmp = (LAMMPS *) handle;
-
-  BEGIN_CAPTURE
-  {
-    lmp->modify->addstep_compute_all(newstep);
-  }
-  END_CAPTURE
+  lmp->modify->addstep_compute_all(newstep);
 }
 /* ---------------------------------------------------------------------- */
 
@@ -3033,12 +3023,7 @@ void lammps_compute_addstep_all(void * handle, bigint newstep) {
  */
 void lammps_compute_addstep(void * handle, bigint newstep) {
   auto lmp = (LAMMPS *) handle;
-
-  BEGIN_CAPTURE
-  {
-    lmp->modify->addstep_compute(newstep);
-  }
-  END_CAPTURE
+  lmp->modify->addstep_compute(newstep);
 }
 
 // ----------------------------------------------------------------------