Pull requests: mdtraj/mdtraj
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Add atom selection via atom_indices to SASA computation (try #2, three years after)
#1844
opened Dec 27, 2023 by
gph82
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[compute_contacts] new option for optarg scheme="backbone", tests added
#1832
opened Nov 14, 2023 by
gph82
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residue.is_nucleic and 'nucleic' in atom selection DSL
wontfix
#1398
opened Nov 11, 2018 by
dwhswenson
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