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Commit fedeefa5 authored by M.D. Driver's avatar M.D. Driver
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change to int.

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solventmapcreator/solvationcalculation/solvationplotinformation.py
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...@@ -26,7 +26,7 @@ def create_input_data_labels(epsilon_i_list, epsilon_j_list, x_label, y_label): ...@@ -26,7 +26,7 @@ def create_input_data_labels(epsilon_i_list, epsilon_j_list, x_label, y_label):
""" """
axis_range = get_axis_range(epsilon_i_list, epsilon_j_list) axis_range = get_axis_range(epsilon_i_list, epsilon_j_list)
return {"x_label":x_label, "y_label":y_label, "plot_axis_range":axis_range, return {"x_label":x_label, "y_label":y_label, "plot_axis_range":axis_range,
"levels":[2*x -31.0 for x in range(32)]} "levels":[2*x -31 for x in range(32)]}
def create_input_data_values(epsilon_i_list, epsilon_j_list, temperature, theta, polynomial_coefficients): def create_input_data_values(epsilon_i_list, epsilon_j_list, temperature, theta, polynomial_coefficients):
"""This calculates the association energy matrix, and also generates the meshgrids ofthe x and y data. """This calculates the association energy matrix, and also generates the meshgrids ofthe x and y data.
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