Remove structure set

[jan-janssen]

Summary by CodeRabbit

• New Features

  • Simplified logic for setting new structures in the application, allowing for greater flexibility when changing chemical structures.

• Potential Impact

  • Users may encounter situations where incompatible structures are accepted, which could affect subsequent operations.

[coderabbitai[bot]]

Walkthrough

The recent changes to the interactive_structure_setter function in pylammpsmpi/wrapper/ase.py streamline its logic by removing the validation that checks for consistency between existing and new chemical symbols. This alteration simplifies the function, allowing new structures to be accepted without prior checks, which might lead to potential issues in future operations that rely on consistent chemical data.

Changes

Files	Change Summary
pylammpsmpi/wrapper/ase.py	Modified interactive_structure_setter function to remove the check for matching chemical symbols, simplifying logic.

Poem

In the warren where ideas hop,
A change was made—no need to stop!
Symbols no longer must agree,
Structures now dance, wild and free.
So let us celebrate this new decree,
A world of structures awaits, oh me! 🐇✨

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