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Fix incorrect default in CLI #5

Merged
merged 1 commit into from
Sep 30, 2023
Merged

Fix incorrect default in CLI #5

merged 1 commit into from
Sep 30, 2023

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davidkastner
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The default had been set to include waters in the cluster models. Given the substrates were not being included by default it makes sense to not include waters as well for the default. It should just be the metal and the proteogenic environment.

@davidkastner davidkastner merged commit b4c049c into main Sep 30, 2023
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@davidkastner davidkastner deleted the fix-defualt branch September 30, 2023 18:30
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