Molegro Virtual Docker versions

Molegro Virtual Docker predicts protein-ligand interactions, from preparation to binding modes
5.5
Nov 23, 2012
Review
5.0
Mar 14, 2012
4.3
Feb 21, 2011
Review
4.2
Oct 27, 2010
Review
4.1
Jun 22, 2010
4.0
Dec 15, 2009
0.8
Jun 18, 2009

What's new

v5.5 [Nov 23, 2012]
- A new 'Energy Maps' tool provides volumetric visualization of protein force fields. This makes it possible to understand why a compound interacts with a given receptor, and may provide insights on how to improve the binding.
- A new execution mode in the Docking Wizard: 'Run Docking in Multiple Processes'. This makes it possible to run medium sized jobs on a local machine, while utilizing multiple CPU cores and even multiple GPU graphics cards. For large jobs on multiple machines, Molegro Virtual Grid should still be used.
- The ray-tracer has been improved to more closely match the live 3D view output. This makes it possible to create high resolution renderings of the 3D view.
- Minor user interface improvements and bug fixes.