Add interactive offset_y
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2 changed files with 25 additions and 6 deletions
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@ -341,11 +341,13 @@ def read_data(data, options={}, index=0):
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diffractogram, wavelength = read_xy(data=data, options=options, index=index)
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diffractogram, wavelength = read_xy(data=data, options=options, index=index)
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if options['normalise']:
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diffractogram['I'] = diffractogram['I'] / diffractogram['I'].max()
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if options['offset']:
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if options['offset'] or options['normalise']:
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# Make copy of the original intensities before any changes are made through normalisation or offset, to easily revert back if need to update.
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diffractogram['I_org'] = diffractogram['I']
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diffractogram['2th_org'] = diffractogram['2th']
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diffractogram = apply_offset(diffractogram, wavelength, index, options)
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diffractogram = apply_offset(diffractogram, wavelength, index, options)
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@ -355,13 +357,21 @@ def read_data(data, options={}, index=0):
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def apply_offset(diffractogram, wavelength, index, options):
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def apply_offset(diffractogram, wavelength, index, options):
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options['current_offset_y'] = options['offset_y']
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options['current_offset_x'] = options['offset_x']
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#Apply offset along y-axis
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#Apply offset along y-axis
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diffractogram['I_org'] = diffractogram['I'] # make copy of original intensities
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diffractogram['I'] = diffractogram['I_org'] # Reset intensities
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if options['normalise']:
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diffractogram['I'] = diffractogram['I'] / diffractogram['I'].max()
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diffractogram['I'] = diffractogram['I'] + index*options['offset_y']
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diffractogram['I'] = diffractogram['I'] + index*options['offset_y']
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# Apply offset along x-axis
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# Apply offset along x-axis
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relative_shift = (wavelength / 1.54059)*options['offset_x'] # Adjusts the offset-factor to account for wavelength, so that offset_x given is given in 2th_cuka-units
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relative_shift = (wavelength / 1.54059)*options['offset_x'] # Adjusts the offset-factor to account for wavelength, so that offset_x given is given in 2th_cuka-units
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diffractogram['2th_org'] = diffractogram['2th']
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diffractogram['2th'] = diffractogram['2th_org']
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diffractogram['2th'] = diffractogram['2th'] + index*relative_shift
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diffractogram['2th'] = diffractogram['2th'] + index*relative_shift
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@ -81,6 +81,13 @@ def plot_diffractogram(data, options={}):
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options['xlim'] = [diffractogram[options['x_vals']].min(), diffractogram[options['x_vals']].max()]
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options['xlim'] = [diffractogram[options['x_vals']].min(), diffractogram[options['x_vals']].max()]
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if options['interactive_session_active']:
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if options['offset']:
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if (options['offset_x'] != options['current_offset_x']) or (options['offset_y'] != options['current_offset_y']):
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for i, (diff, wl) in enumerate(zip(data['diffractogram'], data['wavelength'])):
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xrd.io.apply_offset(diff, wl, i, options)
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# Start inteactive session with ipywidgets. Disables options['interactive'] in order for the interactive loop to not start another interactive session
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# Start inteactive session with ipywidgets. Disables options['interactive'] in order for the interactive loop to not start another interactive session
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if options['interactive']:
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if options['interactive']:
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options['interactive'] = False
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options['interactive'] = False
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@ -156,7 +163,9 @@ def plot_diffractogram(data, options={}):
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if options['interactive_session_active']:
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if options['interactive_session_active']:
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btp.update_widgets(options=options)
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btp.update_widgets(options=options)
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xrd.io.up
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return diffractogram, fig, ax
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return diffractogram, fig, ax
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