removed obsolete functions from lib.distances#2073
removed obsolete functions from lib.distances#2073zemanj merged 9 commits intoMDAnalysis:developfrom
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…hedral() from lib.distances
…> calc_angles, calc_dihedral -> calc_dihedrals in analysis.hbonds and in core.topologyobjects
…nd calc_dihedral into tests for single coordinate input of calc_bonds, calc_angles, and calc_dihedrals
… lib.distances to better reflect the possibility of single coordinate input
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Regarding my latest commit: The precision used to be 3 decimals in the tests for |
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Ok this seems good to go. |
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@richardjgowers The tests are still quite an unstructured mess though... |
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@richardjgowers Thanks for reviewing! |
Fixes #2072
Changes made in this Pull Request:
calc_distance,calc_angle, andcalc_dihedralfromlib.distancescalc_bonds,calc_angles, andcalc_dihedrals, respectivelycalc_bonds,calc_angles, andcalc_dihedralsfor single coordinate inputcalc_bonds,calc_angles, andcalc_dihedralsto better reflect the possibility of single coordinate input (also related to issue MDAnalysis.lib.distances needs rework #2046)PR Checklist