cc_staff
163
edits
OpenMM: Difference between revisions
→Preparing Python Virtual Environment
mNo edit summary |
|||
| Line 5: | Line 5: | ||
== Preparing Python Virtual Environment == | == Preparing Python Virtual Environment == | ||
This example is for the openmm/7.7.0 module. | |||
ml python | |||
virtualenv env-parmed | |||
source env-parmed/bin/activate | |||
pip install parmed==3.4.3 netCDF4 | |||
== Job submission == | == Job submission == | ||