Dear Amber experts,
I am trying to install parallel version of ambertools20. I
followed the procedure given the amber20.pdf. I could install all the
parallel codes expect MMPBSA.py.MPI.
In the note section it was mentioned that, the installation
depends on mpi4py build. I installed mpi4py using conda install mpi4py and
it got installed. I used miniconda of ambertools for this purpose.
What needs to be done to get MMPBSA.py.parallel version.
Thanks,
Divya.
Dr. Divya Bharathi,
Post Doctoral Fellow,
IIIT
Hyderabad-500032.
INDIA.
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Received on Thu Dec 03 2020 - 11:00:03 PST
