Introduction to molecular mechanics with MOE: Why does GFP need a beta-barrel shell?

Submitted by pogorelo on Thu, 08/26/2010 - 10:29

This tutorial is an introduction to performing molecular dynamics in MOE. Topics include: building a small molecule, visualization, preparing and performing minimization in the gas phase and in solution, basic analysis of molecular properties. 

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SCS-UIUC-moe-tutorial-MD-ver_2-17-August-2016.pdf 847.44 KB