Biological & Soft Matter Seminar: 30 Years of Reaction Path Calculations
Ron Elber, The University of Texas at Austin
11 December 2024, 11:00
Kaplun Building, Flekser Hall 118
Abstarct:
In this talk, I will describe how reaction path calculations can be used to quantitatively and qualitatively investigate complex processes in molecular biophysics. I will briefly mention how the calculations are conducted and move on to describe a series of examples. I will consider charge transport across membranes, the enzymatic reaction of HIV reverse transcriptase, early events in the function of the anthrax toxin, and PIP2 binding to TRPV5.
