open-reaction-database ord-schema issues

open-reaction-database / ord-schema

Schema for the Open Reaction Database

https://open-reaction-database.org

Apache License 2.0

91 stars 26 forks source link

issues

Newest

Newest Most commented Recently updated Oldest Least commented Least recently updated

Script to profile the ORM

#732 skearnes closed 1 day ago
1
Add indexes for foreign key columns

#731 skearnes closed 3 days ago
0
Upgrade to psycopg 3

#730 skearnes closed 3 days ago
1
Fix for parse_doi

#729 skearnes closed 4 days ago
0
DOI parser false alarm

#728 qai222 closed 4 days ago
1
' type: NAME': Enum type "ord.ReactionIdentifier.ReactionIdentifierType" has no value named NAME.

#727 bdeadman opened 1 week ago
2
Explicit tests for #672

#726 skearnes closed 2 weeks ago
4
Simplify ORM dataset ingestion

#725 skearnes closed 2 weeks ago
0
Add num_reactions to dataset table

#724 skearnes closed 3 weeks ago
1
Move database query classes/functions to ord-schema

#723 skearnes closed 3 weeks ago
1
Update ReactionRole use in get_reaction_smiles

#722 skearnes closed 3 weeks ago
3
`add_rdkit` not found in `ord_schema.orm.database`

#721 qai222 closed 2 weeks ago
3
Use isort

#720 skearnes closed 1 month ago
0
Add addition device types, and analysis types

#719 FanwangM closed 1 month ago
1
Added some addition device types, and analysis types.

#718 bdeadman closed 1 month ago
2
Rearrange dependencies

#717 skearnes opened 2 months ago
0
Fix ord-schema tests

#716 skearnes closed 2 months ago
1
ord-schema tests are failing

#715 skearnes closed 2 months ago
0
Slow delete/updates with database

#714 Stonemansrs closed 3 days ago
10
add compiler option to export pyi files

#713 qai222 closed 4 months ago
1
Pip installation not working(?)

#712 jtheligand closed 4 months ago
5
Code completion of protobuf classes in VSCode

#711 ottokruse closed 4 months ago
6
Test on Apple silicon

#710 skearnes closed 4 months ago
1
Remove psycopg2 as mandatory dependency because the library works without it and it throws errors if not installed

#709 ottokruse closed 2 months ago
3
Add Pipette as AdditionDevice option

#708 connorcoley closed 3 days ago
5
Dockerfile failing

#707 aeinspanier closed 4 months ago
2
Updated links to the ORD web search/browse and editor interfaces

#706 bdeadman closed 2 months ago
1
Add Example for Converting .pb to JSON

#705 brucejwittmann closed 2 months ago
7
google.protobuf.message.DecodeError: Wrong wire type in tag.

#704 Da-vid21 closed 2 months ago
2
Update advisory board

#703 connorcoley closed 8 months ago
1
Add foreign keys to rdkit tables

#702 skearnes closed 9 months ago
1
Fix bug of parsing of reactants in building the reaction SMILES

#701 FanwangM closed 9 months ago
1
Update protocol complier usage because of protobuf updates

#700 FanwangM closed 9 months ago
2
Fix problem of generating dataset when having `reaction_id` in the template (#697)

#699 FanwangM closed 10 months ago
3
use `Texture` for `ReactionInput` and `Compound`

#698 qai222 closed 9 months ago
8
Enumeration script creates invalid datasets when reaction_id included

#697 connorcoley closed 10 months ago
0
A `phase` or `texture` field for Compound and ReactionInput

#696 qai222 closed 3 days ago
4
Unique entries in rdkit tables

#695 skearnes closed 11 months ago
1
Add unit conversion method to UnitResolver

#694 connorcoley closed 11 months ago
1
Improve unit conversions and representations

#693 connorcoley closed 11 months ago
0
Validation patch to change Compound Identifier strictness

#692 connorcoley closed 11 months ago
1
Option `ValidationOptions(allow_reaction_smiles_only=False)` has no effect in `validate_message` or `validate_datasets`

#691 alexarnimueller closed 11 months ago
4
fix typo in convention

#690 qai222 closed 12 months ago
1
put rdkit functions in the public schema

#689 skearnes closed 11 months ago
1
Add is_mined flag for text mining data

#688 skearnes closed 1 year ago
1
Track dataset changes with MD5

#687 skearnes closed 1 year ago
1
Require provenance by default

#686 skearnes closed 1 year ago
1
Use MD5 to track dataset versions in the ORM

#685 skearnes closed 1 year ago
0
reaction role

#684 qai222 closed 12 months ago
4
Stoichiometry

#683 qai222 closed 1 year ago
1