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buildamol
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Complexity
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Issues
A
buildamol\resources\pubchem.py
67 1 -
A
buildamol\structural\stitch.py
64 5 1
A
buildamol\utils\convert.py
64 1 1
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buildamol\optimizers\base_rotatron.py
61 2 -
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buildamol\structural\base.py
60 1 -
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buildamol\structural\patch.py
57 1 -
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buildamol\utils\auxiliary.py
56 3 -
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buildamol\extensions\complexes\metal_complexer.py
56 1 2
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tests\test_optimizers.py
55 5 -
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buildamol\utils\pdb.py
52 3 -
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buildamol\extensions\bio\glycans\iupac.py
52 2 -
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buildamol\optimizers\utils.py
44 3 -
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buildamol\utils\json.py
39 1 -
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buildamol\extensions\complexes\rotaxane_builder.py
31 2 -
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tests\test_pdbe_compounds.py
27 6 -
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buildamol\extensions\molecular_dynamics\atom_typing\atom_typer.py
27 2 -
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buildamol\extensions\molecular_factories\assembler.py
26 6 -
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buildamol\extensions\polymers\polycarbons.py
25 2 -
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buildamol\extensions\molecular_dynamics\psf.py
25 1 -
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buildamol\optimizers\distance_rotatron.py
24 2 -