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NanoCIPHER-Lab / topotools Public

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WIP: Numerical sorting of all types#1

Open

jotelha wants to merge 5 commits intoNanoCIPHER-Lab:masterNanoCIPHER-Lab/topotools:masterfrom

jotelha:2026-02-05-numerical-sorting-of-all-typesjotelha/topotools:2026-02-05-numerical-sorting-of-all-typesCopy head branch name to clipboard

Conversation Commits5 (5)Checks Files changed

Open

WIP: Numerical sorting of all types#1
jotelha wants to merge 5 commits intoNanoCIPHER-Lab:masterfrom
jotelha:2026-02-05-numerical-sorting-of-all-types

Commits

Commits on Feb 5, 2026

ENH: Claude.ai changed alphabetical sorting of atom types to integer sorting
jotelha
committed
MAINT: changed bond, angle, dihedral, improper style ordering
jotelha
committed
ENH: fix type numbers in bond, angle, dihedral, improper sections as well
jotelha
committed
Revert "MAINT: changed bond, angle, dihedral, improper style ordering"
jotelha
committed
MAINT: fixed typos that resulted in all masses being set to 1.0
jotelha
committed

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