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- Wed Mar 21, 2012 4:26 pm
- Forum: OpenMM Zephyr
- Topic: Disulfide bond disappeared after energy minimisation
- Replies: 0
- Views: 414
Disulfide bond disappeared after energy minimisation
Hi, everyone, I am very new to Molecular Dynamics and was hoping someone can help me with this issue that I encountered. I have been trying to do some MD runs with my protein structure, which contains a functionally important disulfide bond, using OpenMM Zephyr. However, the disulfide bond disappear...