In the README.md file, one can read:
"In case the Python script can't see LAMMPS or some other problem arises after finishing the next steps too, an alternative is to use the YML file polymersimulations.yml to create a conda environment called polymersimulations with versions of Python and other packages as given in the file (a little bit old).
conda env create -f polymersimulations.yml"
However, the given command and the yml file seem not to function (generate error messages). I suggest to remove this option from the README.md and stay by the manual creation of 'polymersimulations' Conda environment with all required functionalities.
In the README.md file, one can read:
"In case the Python script can't see LAMMPS or some other problem arises after finishing the next steps too, an alternative is to use the YML file
polymersimulations.ymlto create a conda environment calledpolymersimulationswith versions of Python and other packages as given in the file (a little bit old).conda env create -f polymersimulations.yml"
However, the given command and the yml file seem not to function (generate error messages). I suggest to remove this option from the README.md and stay by the manual creation of 'polymersimulations' Conda environment with all required functionalities.