7398146730
46%

Ran 03 Jan 2024 02:07PM UTC

Jobs 1

Files 72

Run time 7s

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Committed 03 Jan 2024 01:55PM UTC coverage: 39.977% (+0.1%) from 39.839%

Build # 7398146730

Build Type

push

github

Committed by

web-flow

Commit Message

Add glue code which makes records from ligands and nodes (#36)

* Update assemble.py

* Update assemble.py

* Update assemble.py

* Update assemble.py

* Switch test to xfail for now

* Remove unused code, add unit test for paddle wheel

* Create preprocess_linkers.py

* Update preprocess_linkers.py

* Update assemble.py

* Add files via upload

* Implement and test training

* Flake8 fix

* Fix the assembly code, make it return a string

* Update preprocess_linkers.py

* Refactor to avoid disk use

* Update preprocess_linkers.py

* Ensure outputs are XYZ formatted

* Add glue code which creates records

* Change so that PyCharm autoindent doesn't violate flake8

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Co-authored-by: doublylinkedlist <williamyxl@gmail.com>

Run Details

3831 of 9583 relevant lines covered (39.98%)

0.4 hits per line

Jobs

ID	Job ID	Ran	Files	Coverage
1	7398146730.1	03 Jan 2024 02:07PM UTC	72	39.98

globus-labs / mof-generation-at-scale / 7398146730
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