Error with MMPBSA pipeline

185 views
Skip to first unread message

Divpreet kaur

unread,
May 13, 2023, 1:22:13 AM5/13/23
to gmx_MMPBSA
Hi! i ran gmx_mmpbsa sometime back on my PC but now when I am trying to run the entire pipeline again. I am getting an error.
I think ParmEd is not working and its not able to find its path in git hub.
I have attached the image of the error I am getting below.
I ran this command:

Please help me resolve the error. 

With Regards
WhatsApp Image 2023-05-13 at 10.47.05 AM.jpeg

Mario Sergio Valdes

unread,
May 13, 2023, 1:44:34 AM5/13/23
to gmx_MMPBSA
Can you check which version of compilers package you have? 

Mario Sergio Valdes

unread,
May 13, 2023, 4:04:16 AM5/13/23
to gmx_MMPBSA
Please, downgrade the compilers package. Install compilers=1.2.0. We update the installation instructions in the documentation
Reply all
Reply to author
Forward
0 new messages