​Hello, Amber users!
I am receiving the following error message when I try to minimize my system (protein+glycan+peptide in a water box):
Error: Fast 3-point water residue, name and bond data incorrect!
I have originally built my system using CHARMM ff, then converted it to Amber input files using Chamber through Parmed. I cannot imagine what water-related issue can be happening here, and the web results do not seem of great help either. Do you guys have any idea what might be wrong here or what I should examine more carefully?
Thank you!
Artur
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Received on Wed Feb 16 2022 - 13:00:02 PST
