This commit is contained in:
jfsScience 2021-01-13 11:10:36 +01:00
parent 9efe0a8549
commit ce2a47d8e1
9 changed files with 50 additions and 11096 deletions

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# Copyright (c) 2020 Jens Fröhlich
# All rights reserved.
#
# Author: Jens Fröhlich <jefro@fsksoft.de>
#
# Redistribution and use in source and binary forms, with or without
# modification, are permitted provided that the following conditions
# are met:
# 1. Redistributions of source code must retain the above copyright
# notice, this list of conditions and the following disclaimer.
# 2. Redistributions in binary form must reproduce the above copyright
# notice, this list of conditions and the following disclaimer in the
# documentation and/or other materials provided with the distribution.
#
# THIS SOFTWARE IS PROVIDED BY THE AUTHOR AND CONTRIBUTORS ``AS IS'' AND
# ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE
# IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE
# ARE DISCLAIMED. IN NO EVENT SHALL AUTHOR OR CONTRIBUTORS BE LIABLE
# FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR CONSEQUENTIAL
# DAMAGES (INCLUDING, BUT NOT LIMITED TO, PROCUREMENT OF SUBSTITUTE GOODS
# OR SERVICES; LOSS OF USE, DATA, OR PROFITS; OR BUSINESS INTERRUPTION)
# HOWEVER CAUSED AND ON ANY THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT
# LIABILITY, OR TORT (INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY
# OUT OF THE USE OF THIS SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF
# SUCH DAMAGE.
import tkinter as tk
import matplotlib.pyplot as plt
#matplotlib.use("TkAgg")

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@ -1,4 +1,29 @@
# Copyright (c) 2020 Jens Fröhlich
# All rights reserved.
#
# Author: Jens Fröhlich <jefro@fsksoft.de>
#
# Redistribution and use in source and binary forms, with or without
# modification, are permitted provided that the following conditions
# are met:
# 1. Redistributions of source code must retain the above copyright
# notice, this list of conditions and the following disclaimer.
# 2. Redistributions in binary form must reproduce the above copyright
# notice, this list of conditions and the following disclaimer in the
# documentation and/or other materials provided with the distribution.
#
# THIS SOFTWARE IS PROVIDED BY THE AUTHOR AND CONTRIBUTORS ``AS IS'' AND
# ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE
# IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE
# ARE DISCLAIMED. IN NO EVENT SHALL AUTHOR OR CONTRIBUTORS BE LIABLE
# FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR CONSEQUENTIAL
# DAMAGES (INCLUDING, BUT NOT LIMITED TO, PROCUREMENT OF SUBSTITUTE GOODS
# OR SERVICES; LOSS OF USE, DATA, OR PROFITS; OR BUSINESS INTERRUPTION)
# HOWEVER CAUSED AND ON ANY THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT
# LIABILITY, OR TORT (INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY
# OUT OF THE USE OF THIS SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF
# SUCH DAMAGE.
from tkinter.colorchooser import askcolor
from tkinter import Variable, filedialog
from tkinter import messagebox

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@ -5,7 +5,5 @@ nm_step = 0.12714
baseline_limit = 100
[methods]
crystal = 1,576,mymol,0.0,5,15|1,3.0,0.23294505746566566,80,100000|2,6.0,0.5003896696237482,80,100000|3,9.0,0.6314310052189019,80,100000|4,12.0,0.7934140103632163,80,100000|5,15.0,1.1044743475181251,80,100000
crystalx = 0,576,mymol,0.0,5,15|1,3.0,0.23572229297382125,80,100000|2,6.0,0.49418983232280744,80,100000|3,9.0,0.6972117246796802,80,100000|4,12.0,0.8832872046419623,80,100000|5,15.0,1.0800630625574945,80,100000
test = 0,405,mmol,0.0,5,30|1,6.0,0.0,200,100000|2,12.0,0.0,200,100000|3,18.0,0.0,0,0|4,24.0,0.0,0,0|5,30.0,0.0,0,0

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