Python script samples
DmitriyMarin last edited by
You can find a number of Python script samples for SAMSON in our github repository: https://github.com/1A-OneAngstrom/SAMSON-Python-Samples
I browsed the github repository, but I don't see any examples of building a molecule with Python. Is that possible? Can I define a list of coordinates and, for example, insert a carbon atom at each of those coordinates? The weave nanotube example is way too complex for what I'm trying to start with.
DmitriyMarin last edited by DmitriyMarin
Dear @Tom-1 ,
We have added an example of how to build molecules using Python Scripting in SAMSON, please see SAMSON-Python-Samples > building.
Please let us know if you have any questions or feedback.