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Merge pull request #3524 from ssande7/respa_fix

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Fix segfault when using dynamic groups with r-RESPA
This commit is contained in:
Axel Kohlmeyer
2022-11-17 17:13:15 -05:00
committed by GitHub
parent 4655039774 c191086812
commit 94cc3f6590
1 changed files with 1 additions and 1 deletions
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src/respa.cpp
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@ -372,7 +372,7 @@ void Respa::setup(int flag)
mesg += fmt::format(" {}:{}", ilevel + 1, step[ilevel]); mesg += fmt::format(" {}:{}", ilevel + 1, step[ilevel]);
mesg += "\n r-RESPA fixes :"; mesg += "\n r-RESPA fixes :";
for (int l = 0; l < modify->n_post_force_respa_any; ++l) { for (int l = 0; l < modify->n_post_force_respa; ++l) {
Fix *f = modify->get_fix_by_index(modify->list_post_force_respa[l]); Fix *f = modify->get_fix_by_index(modify->list_post_force_respa[l]);
if (f->respa_level >= 0) if (f->respa_level >= 0)
mesg += fmt::format(" {}:{}[{}]", MIN(f->respa_level + 1, nlevels), f->style, f->id); mesg += fmt::format(" {}:{}[{}]", MIN(f->respa_level + 1, nlevels), f->style, f->id);