def show_multiple_assignment_table(self, categorized_peaks):
ctext = ('The table below shows peak counts for peaks with more\n' +
'than one possible assignment. These are categorized\n' +
'according to the shortest range assignment possible,\n' +
'intra residue, sequential, medium (2-4 residues), or\n' +
'long (5 or more residues apart). The first line shows\n' +
'peaks having exactly one possible assignment of shortest\n' +
'range with additional longer range possiblities. The next\n'
+ 'line shows peak counts with 2 possible assignments of\n' +
'shortest range, ...\n\n')
self.text.insert('end', ctext)
rline = '%10s' % ''
for r in range_names:
rline = rline + ('%6s' % r)
self.text.insert('end', rline + '\n')
for range in ('1', '2', '3', '4+'):
self.text.insert('end', '%-10s' % range)
pline = ''
uniqueness = range + '-shortest'
for shortest_range in range_names:
category = (uniqueness, shortest_range)
if categorized_peaks.has_key(category):
count = len(categorized_peaks[category])
tag = uniqueness + '-' + shortest_range
self.text.insert('end', '%6d' % count, tag)
cb = pyutil.postcompose(self.show_category_cb, category)
self.text.tag_bind(tag, '<ButtonPress-1>', cb)
else:
self.text.insert('end', '%6s' % '')
self.text.insert('end', '\n')
def show_shortest_range_table(self, peaks_by_range):
ctext = 'Counts of peaks by shortest range assignment.\n\n'
self.text.insert('end', ctext)
rline = ''
for r in range_names:
rline = rline + ('%6s' % r)
self.text.insert('end', rline + '\n')
cline = ''
for range_name in range_names:
if peaks_by_range.has_key(range_name):
count = len(peaks_by_range[range_name])
tag = range_name + '-peaks'
self.text.insert('end', '%6d' % count, tag)
cb = pyutil.postcompose(self.show_range_cb, range_name)
self.text.tag_bind(tag, '<ButtonPress-1>', cb)
else:
self.text.insert('end', '%6s' % '')
self.text.insert('end', '\n\n')
def draw_assignments(self, peak_assignments, color):
lines = {}
for peak, assignment in peak_assignments:
nums = []
for r in assignment:
if r.atom.nucleus == '1H':
nums.append(r.group.number)
if len(nums) == 2:
pyutil.table_push(lines, tuple(nums), peak)
for (num1, num2), peaks in lines.items():
b = self.position[num1]
e = self.position[num2]
id = self.canvas.create_line(b[0],
b[1],
e[0],
e[1],
width=len(peaks),
fill=color)
cb = pyutil.postcompose(self.show_peaks_cb, peaks)
self.canvas.tag_bind(id, '<ButtonPress-1>', cb)
def show_unique_assignment_table(self, categorized_peaks):
ctext = 'Peaks with one possible assignment.\n\n'
self.text.insert('end', ctext)
rline = ''
for r in range_names:
rline = rline + ('%6s' % r)
self.text.insert('end', rline + '\n')
cline = ''
for range_name in range_names:
category = ('unique', range_name)
if categorized_peaks.has_key(category):
count = len(categorized_peaks[category])
tag = 'unique-' + range_name
self.text.insert('end', '%6d' % count, tag)
cb = pyutil.postcompose(self.show_category_cb, category)
self.text.tag_bind(tag, '<ButtonPress-1>', cb)
else:
self.text.insert('end', '%6s' % '')
self.text.insert('end', '\n\n')
def show_assignment_count_table(self, categorized_peaks):
ptext = 'Peak counts with 0, 1, 2, ... possible assignments.\n\n'
self.text.insert('end', ptext)
ctable = {}
for category, plist in categorized_peaks.items():
if type(category) == types.IntType:
ctable[category] = 1
counts = ctable.keys()
counts.sort()
cline = ''
for c in counts:
cline = cline + ('%4d' % c)
self.text.insert('end', cline + '\n')
for c in counts:
field = ('%4d' % len(categorized_peaks[c]))
tag = 'count%d' % c
self.text.insert('end', field, tag)
cb = pyutil.postcompose(self.show_category_cb, c)
self.text.tag_bind(tag, '<ButtonPress-1>', cb)
self.text.insert('end', '\n\n')