AttributeError: 'MMPBSA_API' object has no attribute 'timestep'

[Shreyasi Das]

I encountered this issue while trying to run load data from _GMXMMPBSA_info. I am using python3.8 and have gmxMMPBSA environment set up in conda. I can also import GMXMMPBSA but when I try to load the data, I get the error "AttributeError: 'MMPBSA_API' object has no attribute 'timestep'". How to solve this issue?

Thank you for your help in advance.

[Mario Sergio Valdes]

The current API has limitations. Please, refer to this issue (https://github.com/Valdes-Tresanco-MS/gmx_MMPBSA/issues/347) to know how to use it.

We are working on a better API

Best