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Minor fix in JOSS submission.
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Miha Purg committed Sep 5, 2018
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Expand Up @@ -108,3 +108,9 @@ Usages include: parameter conversion from MacroModel (OPLS) or AMBER formats (`q
#### Graphical interface

Finally, `qtools` comes with a GUI application `q_plot.py` for visualizing results and troubleshooting simulations. `q_plot.py` displays the data generated by CLI tools, *i.e.* free energy profiles, LRA contributions, LRA group contributions, potential energy breakdown, kinetic energy, temperature, *etc.*, which is especially useful in troubleshooting simulations in Q. Some examples of use are demonstrated in reference [@purg:2018]


# Acknowledgments

I thank Dr. Janez Mavri and Dr. Paul Bauer for all the helpful discussions and support.

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