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Feature #3427

Feature #3417: Make modular simulator feature-complete

Support freeze groups in modular simulator

Added by Pascal Merz 3 months ago.

Status:
New
Priority:
Normal
Assignee:
Pascal Merz
Category:
mdrun
Target version:
2021-infrastructure-stable
Difficulty:
uncategorized
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Description

The propagators of modular simulator need to be able to handle freeze groups.

Related issues

Related to GROMACS - Feature #3428: Implement SIMD version of modular simulator propagatorsNew

History

#1 Updated by Pascal Merz 3 months ago

  • Related to Feature #3428: Implement SIMD version of modular simulator propagators added

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