fatmacankara commited on
Commit
9280c78
·
1 Parent(s): e507403

Update code/add_alignment.py

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Files changed (1) hide show
  1. code/add_alignment.py +12 -12
code/add_alignment.py CHANGED
@@ -7,24 +7,24 @@ from Bio.pairwise2 import format_alignment
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  def do_alignment(identifier, uniprotSequence, pdbSequence, alignment_path):
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- print(f'Aligning Datapoint: {identifier}')
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- print(pdbSequence)
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- print('uniprot Seq')
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- print(uniprotSequence)
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  #if len(pdbSequence) >= 1:
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  #f = open(Path(alignment_path / f'{identifier}_alignment.txt'),"w")
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  aligner.mode = 'local'
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- print('1')
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  aligner.substitution_matrix = substitution_matrices.load("BLOSUM62")
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- print('2')
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  aligner.open_gap_score = -11
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- print('3')
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  aligner.extend_gap_score = -1
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- print('4')
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- print(aligner.align(uniprotSequence, pdbSequence))
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- alignments = aligner.align(uniprotSequence, pdbSequence)
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- print('Alignments')
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- print(alignments)
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  """
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  alignments = (list(alignments))
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  alignment_list = []
 
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  def do_alignment(identifier, uniprotSequence, pdbSequence, alignment_path):
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+ st.write(f'Aligning Datapoint: {identifier}')
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+ st.write(pdbSequence)
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+ st.write('uniprot Seq')
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+ st.write(uniprotSequence)
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  #if len(pdbSequence) >= 1:
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  #f = open(Path(alignment_path / f'{identifier}_alignment.txt'),"w")
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  aligner.mode = 'local'
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+ st.write('1')
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  aligner.substitution_matrix = substitution_matrices.load("BLOSUM62")
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+ st.write('2')
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  aligner.open_gap_score = -11
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+ st.write('3')
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  aligner.extend_gap_score = -1
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+ st.write('4')
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+ st.write(aligner.align(uniprotSequence, pdbSequence)[0])
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+ alignments = aligner.align(uniprotSequence, pdbSequence)[0]
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+ st.write('Alignments')
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+ st.write(alignments)
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  """
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  alignments = (list(alignments))
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  alignment_list = []