Hello Vaibhav,
>
> Can you please suggest which tools can be used to create selected mutants
> automatically (via command-line) which can then be used in tleap to
> generate files for MD and subsequently analysis?
I think you’ll find a script for the Modeller program very useful: https://salilab.org/modeller/wiki/Mutate%20model <https://salilab.org/modeller/wiki/Mutate%20model>.
I had a similar question over a year ago for a high-throughput mutagenesis project and this solution worked quite nicely.
Best,
Matthew
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Received on Fri Jul 30 2021 - 08:00:02 PDT
