Issues

• ValueError: Buffer dtype mismatch, expected 'int32' but got 'long long'

  biotite-dev/hydride#30 · Filter by author Little-Ghost opened on Jul 28, 2026

• Hydride incompatible with biotite 1.7.1

  biotite-dev/hydride#29 · Filter by author prihoda opened on Jul 15, 2026

• hydride produces identically-oriented hydrogens on water

  biotite-dev/hydride#28 · Filter by author mihaitodor opened on Apr 20, 2026

• Incorrect bonds after add_hydrogen() for proteins with non-consecutive residue indices

  biotite-dev/hydride#27 · Filter by author Grifonek opened on Apr 1, 2026

• The charge is assigned by estimate_amino_acid_charges incorrectly if heteroresidue is bonded to functional group

  bug
  biotite-dev/hydride#25 · Filter by author dargen3 opened on Dec 9, 2024
  4

• How to deal with the system containing metals?

  biotite-dev/hydride#24 · Filter by author 0ut0fcontrol opened on Nov 21, 2024
  2

• Minimization sometimes does not terminate

  bug
  biotite-dev/hydride#23 · Filter by author ncoish opened on Nov 18, 2024
  6

• Suggestion for a better way to protonate ligands.

  biotite-dev/hydride#17 · Filter by author dargen3 opened on Oct 17, 2024
  4