0.1.92

fix collation issue with output_atompos_indices

0.1.91

first allow for reordering the atom positions being sampled by passin…

0.1.90

update distogram atom to alpha carbon on peptides for now

0.1.89

fix the use of `asym_id` for figuring out the first molecule in each …

0.1.88

complete the logic for designating the peptide and phosphodiesterase …

0.1.86

use repeat_interleave for building sym_id, entity_id, atom_parent_ids

0.1.85

complete `additional_molecule_feats`

0.1.84

add entity_ids in additional_molecule_feats

0.1.83

manually indicate the hydroxyl group that needs to be removed when ch…

0.1.82

0.1.82