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Published 20 hours ago • verified publisher icon Valdes-Tresanco-MS

[ENH]: Remove topology generation from Structure

Open Valdes-Tresanco-MS opened this issue 2 years ago • 0 comments

Practically, the generation of topologies using tLeap is unnecessary since the conversion with ParmEd works perfectly. It also makes the code more complex, making it difficult to implement new functions. We should remove this functionality

Valdes-Tresanco-MS avatar Mar 04 '22 20:03 Valdes-Tresanco-MS