[Chimera-users] Conformation Search in Chimera

Maj Krumberger mkrumber at uci.edu
Wed May 6 11:23:23 PDT 2020


We are currently developing an educational exercise in Chimera for building
different inhibitors in different proteases, using Chimera and then using
AutoDock Vina for finding potential docking sites. I was wondering if there
is a function in Chimera for doing a conformational search that we could
do  to find the lowest energy conformer before running AutoDock Vina?

Thank you,

Maj Krumberger

Graduate Student - Nowick Group
Department of Chemistry
maj.krumberger at uci.edu

University of California, Irvine
4302 Natural Sciences I
Irvine, CA 92697-2025
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