Code

scfix behaviour change#621

Code

Merged

pckroon merged 8 commits intomarrink-lab:mastermarrink-lab/vermouth-martinize:masterfrom csbrasnett:scfix-default-changecsbrasnett/vermouth-martinize:scfix-default-changeCopy head branch name to clipboardOct 24, 2024

+2,479-17

Commits

Commits on Oct 21, 2024

• Initial change in argument

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  e23fb3e

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• Update defaults and correct commands. Merge with marrink-lab#622

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  ec15581

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• add extra integration test to make sure new defaults are applied

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  38229f5

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• fixed failing name_moltype test

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  09283b8

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• removed superfluous flag in an integration test

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  5550cfd

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• changed -cys default argument to 'auto' and corrected tests

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  24fb8fa

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• changing scfix behaviour

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• nitpick changes

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