Segmentation fault during gmx lie
Hello.
When I try the gmx lie, I’m always facing with this error. **'Command line: gmx lie -f ie.edr -Elj -5.88157 -Eqq 48.1747 -ligand chain_b
Opened ie.edr as single precision energy file Segmentation fault’**
I cannot find what is matter. Can you tell me how i can figure it out?
I attached my input file(ie.edr) ie.edr
Thank you.