paconius 9d0f15172f Make Cartridge @= operator coordinate agnostic (#8488) ...

* Modified CXSmiles comparison to ignore coords

* Added @= tests for coordinate change in mol

* Added test output for Issue #8465

2025-05-01 05:21:08 +02:00

..

avalon.sql

fixes #2700 (#2767)

2019-11-15 16:46:10 +01:00

bfpgin.sql

refactoring of the postgresql cartridge (#992)

2016-08-01 07:30:03 +02:00

bfpgist-91.sql

fixes #2700 (#2767)

2019-11-15 16:46:10 +01:00

btree.sql

fix problem in the new is_smiles_valid()

2010-12-11 16:13:27 +00:00

fmcs.sql

Fix some compile-time warnings in the postgres cartridge code (#4657)

2021-11-01 04:35:10 +01:00

fpgist.sql

initial import

2010-07-02 06:57:26 +00:00

fps.sql

fixes #2700 (#2767)

2019-11-15 16:46:10 +01:00

inchi.sql

Fix #2176: InChI functions should return NULL on un-InChI-able input molecules. (#2177)

2019-01-11 04:51:25 +01:00

json.sql

Fixes #8460 (#8468)

2025-04-28 07:38:50 +02:00

molgist.sql

GiST support to qmol type (#4470)

2021-09-15 21:15:08 +02:00

props.sql

Fixes #5095 (#5096)

2022-03-17 16:36:30 +01:00

query.sql

Add a new parameter to mol_adjust_query_properties for generic query parameters (#6332)

2023-08-03 15:41:43 +02:00

rdkit-91.sql

Make Cartridge @= operator coordinate agnostic (#8488)

2025-05-01 05:21:08 +02:00

reaction.sql

update expected cartridge test results (#3484)

2020-10-12 16:09:03 +02:00

sfpgist.sql

fixes #2700 (#2767)

2019-11-15 16:46:10 +01:00

slfpgist.sql

fixes #2700 (#2767)

2019-11-15 16:46:10 +01:00

xqm.sql

make sure bond attachpt info is pickled (#6698)

2023-09-07 12:21:36 +02:00