Hi
I am using gromacs 2020.6 and I have prepared my protein system and minimize and equilibrized it by charmm gui server and i run the production step by a gpu and at the end i want to get a RMSD xvg but when i select system i am facing with pbc problem since i have 2 zn ion in my system and also when i select protein i got the following error:
Segmentation fault (core dumped)
Please help me to solve the problem or guide me what is my fault
Thanks a lot
safaei