Hello,
I would like to check how chirality affects the binding between two DNA strands. How can I enforce a specific chirality? Should I reparametrize both the S and R conformers, or is it possible to handle this during the simulation?
Thank you.
–
Maciej Spiegel, MPharm PhD
assistant professor
.GitHub <
https://farmaceut.github.io/>
Department of Organic Chemistry and Pharmaceutical Technology,
Faculty of Pharmacy, Wroclaw Medical University
Borowska 211A, 50-556 Wroclaw, Poland
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Thu Oct 10 2024 - 13:00:02 PDT
