To do

1. Add the display list for highlight mode in surface mode
2. Link the GL selection to the mdl selection
3. Create the molecule analysis window

BioSimzLab - display re-organisation

Some thoughts

• Have the simulation replay window based on QGLViewer
• Molecules clickable and linked to new tabs opened for individual analysis
• Redirect the stdout to a textbox
  

libQGLViewer to be assesed

Have found this library possibly useful to upgrade the current GLViewer in BioSimzLab.

Feature planned: docked simzprofile windows

Description: Docked windows listing the profile information
Class: WnTplList, WnAgentList, WnSimzInfo, WnSimzRun
Dependency: BioSimz, QtGui, QtXml

Feature planned: heat map projection

Description: Heat maps projected onto protein surfaces.
Class: Heatmap
Dependency: BIOSIMZ::Color, CGAL::Polyhedron_3

Set-up!

In this blog I will write in as much detail as I can (or, will) about the BioSimz project, a C++ library for conducting large-scale biomolecular simulations.