Hi
Don't forget to source amber.sh before you try to run parmed.
Try this
source $AMBERHOME/amber.sh
or
add these lines in your .bashrc file
#AMBER18
export AMBERHOME=</path_to_amber>/amber18
source $AMBERHOME/amber.sh
Best Regards
Elvis
On Wed, 23 Dec 2020 at 23:29, Jisha B <jisha.b.k0511.gmail.com> wrote:
> Dear all,
>
> I have recently installed AMBER18 in my system and tried to use parmed to
> strip off some ions. But then I got the following error:
>
> Traceback (most recent call last):
> File "/opt/amber18/bin/parmed", line 33, in <module>
> sys.exit(load_entry_point('ParmEd==3.2.0', 'console_scripts',
> 'parmed')())
> File "/opt/amber18/bin/parmed", line 22, in importlib_load_entry_point
> for entry_point in distribution(dist_name).entry_points
> File
>
> "/opt/amber18/miniconda/lib/python3.7/site-packages/importlib_metadata/__init__.py",
> line 558, in distribution
> return Distribution.from_name(distribution_name)
> File
>
> "/opt/amber18/miniconda/lib/python3.7/site-packages/importlib_metadata/__init__.py",
> line 215, in from_name
> raise PackageNotFoundError(name)
> importlib_metadata.PackageNotFoundError: No package metadata was found for
> ParmEd
>
> Could someone suggest why this happen?
> Thank you
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>
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Received on Wed Dec 23 2020 - 20:30:02 PST
