On Thu, May 01, 2025, Trevor Kramer via AMBER wrote:
>
>Congratulations on the new release. We are interested in trying
>out the method described in the paper Advancing Multiscale
>Molecular Modeling with Machine Learning-Derived Electrostatics
>(https://pubs.acs.org/doi/full/10.1021/acs.jctc.4c01792). The paper states
>it is slated to be included in the next release of AmberTools but I can’t
>find a mention of it in the latest manual. Was this code included and if so
>can someone point me to instructions on how to invoke it?
>
>Thanks,
>
>Trevor Kramer
>
I'm cc-ing this question to a couple of the authors, in case they miss the
mailing list post.
Sorry I don't have an answer myself.....dac
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Thu May 01 2025 - 20:30:03 PDT
