求助各位老师，atb生成拓扑报错

xxx127 · 发表于 Post on 2025-3-7 14:20:16

老师们好，利用avogadro画分子之后Optimize the geometry of the molecule，然后用ATB生成拓扑后出现:Unsupported bond length encountered: 0.31nm (C5-C10). This often indicates there is an error in the submitted structure.报错，请问这是什么原因？

牧生 · 发表于 Post on 2025-3-8 08:58:03

原因是：unsupported bond length encountered: 0.31nm (C5-C10). This often indicates there is an error in the submitted structure.

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[GROMACS] 求助各位老师，atb生成拓扑报错

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