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Split mol_to_smiles into a util #48

Merged
merged 1 commit into from
Nov 4, 2023
Merged

Split mol_to_smiles into a util #48

merged 1 commit into from
Nov 4, 2023

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SimonBoothroyd
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Description

This PR splits out the mol_to_smiles from the dimers target into a more general utility.

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  • Ready to go

@SimonBoothroyd SimonBoothroyd enabled auto-merge (squash) November 4, 2023 16:43
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codecov bot commented Nov 4, 2023

Codecov Report

Merging #48 (4e5a2c5) into main (9120b99) will not change coverage.
The diff coverage is 100.00%.

@SimonBoothroyd SimonBoothroyd merged commit f35492f into main Nov 4, 2023
@SimonBoothroyd SimonBoothroyd deleted the mol-to-smiles branch November 4, 2023 16:44
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