GROMACS version:2021.4
GROMACS modification: No
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Command line:
gmx distance -s md_0_10.tpr -f md_0_10_center.xtc -select ‘resname “S34`422” and name O plus resid 94 and name NH’ -oall
Reading file md_0_10.tpr, VERSION 2021.4-Ubuntu-2021.4-2 (single precision)
Reading file md_0_10.tpr, VERSION 2021.4-Ubuntu-2021.4-2 (single precision)
Floating point exception (core dumped)
Does this have anything to do with the fact that Cuda was complied to also include GPU?