# Gromacs-2021.1-qmmm, Aborted (core dumped)

**URL:** <https://ask.bioexcel.eu/t/gromacs-2021-1-qmmm-aborted-core-dumped/3291>\
**Category:** QM/MM for Biomolecular Simulation\
**Created:** [October 10, 2021, 2:19pm UTC](https://ask.bioexcel.eu/t/gromacs-2021-1-qmmm-aborted-core-dumped/3291 "2021-10-10T14:19:39Z")\
**Posts on this page:** 2\
**Page:** 1

<div class="post-metadata">

**Author:** ![Rana1](https://avatars.discourse-cdn.com/v4/letter/r/d26b3c/32.png) [@Rana1](https://ask.bioexcel.eu/u/Rana1)\
**Post date:** [October 10, 2021, 2:19pm UTC](https://ask.bioexcel.eu/t/gromacs-2021-1-qmmm-aborted-core-dumped/3291/1 "2021-10-10T14:19:39Z")

</div>

I am facing a problem running QMMM calculation using gromacs-2021.1-qmmm (cp2k). It is showing Aborted (core dumped) in QM production run through gromacs. Kindly, help.

---

<div class="post-metadata">

**Author:** ![dmorozov](https://avatars.discourse-cdn.com/v4/letter/d/dec6dc/32.png) [@dmorozov](https://ask.bioexcel.eu/u/dmorozov)\
**Post date:** [October 11, 2021, 9:16am UTC](https://ask.bioexcel.eu/t/gromacs-2021-1-qmmm-aborted-core-dumped/3291/2 "2021-10-11T09:16:30Z")

</div>

Hi, could you give an additional inforamtion:

1. Which version are you using (from where it was downloaded?)
2. Could you give full output of gromacs (with error) and mdp file, used to setup simulation?
3. cmake command, that you used to configure this version