Hello, 

I have noticed that the properties of the initial structure in my production run are not the same as the properties of the final structure of the previous step (equilibration). Please find attached the photos. I always check the 'update structure' option in the job tab but am beginning to think the output .xsd file is still the initial structure before dynamics is run and not updated. As such my production run has the same initial structure as the equilibration step instead of having the initial as the final structure of the previous run. Kindly help me resolve this.