Creating Free Energy Diagrams

Free energy diagrams can be created via the FancyPlots GUI or by the subpackage ccu.fancyplots.

To launch the GUI, run:

ccu fed

To use the ccu.fancyplots subpackage, one can also launch the GUI with

import tkinter as tk
from ccu.fancyplots.gui.main import run
root = tk.Tk()
app = FancyPlotsGUI(master=root)
app.master.mainloop()

FancyPlots produces a cache file (extension .fancy) that can be used to initialize FancyPlots with the values from a previous session. To seed FancyPlots with data from a previous session run:

ccu fed --cache=CACHE_FILE

from the command line or

import tkinter as tk
from ccu.fancyplots.gui.main import run
root = tk.Tk()
app = FancyPlotsGUI(cache_file=Path("CACHE_FILE"), master=root)
app.master.mainloop()

within Python.