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The title says it all, I am trying to display in my Jupyter notebook the trajectory obtained from the xtb log file but I cannot find any documentation regarding it, can somebody point me to the right direction?
The text was updated successfully, but these errors were encountered:
LukeTheWalker
changed the title
How to plot xyz trajectory files obtained by running geometry optimization through xib
How to plot xyz trajectory files obtained by running geometry optimization through xtb
Jul 1, 2024
The title says it all, I am trying to display in my Jupyter notebook the trajectory obtained from the xtb log file but I cannot find any documentation regarding it, can somebody point me to the right direction?
The text was updated successfully, but these errors were encountered: