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buildamol
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buildamol\extensions\bio\glycans\__init__.py
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docs\examples\chimera_movie.py
 1 2
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buildamol\graphs\base_graph.py
141 1 1
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environment.yml
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buildamol\extensions\complexes\__init__.py
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support\paper_data\optim_benchmark\benchmark.py
4 1 -
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buildamol\optimizers\__init__.py
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support\paper_data\vs_stk\example_cyclohept_amine_NCore\using_buildamol.py
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.readthedocs.yml
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support\paper_data\vs_stk\example_cylcohept_NCore\using_buildamol.py
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buildamol\optimizers\base_rotatron.py
61 2 -
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support\paper_data\vs_stk\example_macrocycle\using_buildamol.py
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buildamol\extensions\complexes\rotaxane_builder.py
31 2 -
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buildamol\optimizers\constraint_rotatron.py
13 1 -
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.github\workflows\pypi-publish.yml
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buildamol\__init__.py
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buildamol\core\__init__.py
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buildamol\extensions\bio\nucleic_acids\__init__.py
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buildamol\extensions\molecular_dynamics\atom_typing\charmm_typer.py
10 1 -
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buildamol\structural\connector.py
20 1 1