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Molegro Virtual Docker v1.1.2 released

The latest version of Molegro Virtual Docker (MVD v1.1.2) was released on June 26th, 2006. We highly recommend MVD users to update to this version.

Notice that although the program normally checks for updates on startup, some corporate firewalls do not allow this type of traffic.

In addition to minor bug fixes, the last two versions of Molegro Virtual Docker added support for sequence viewing, cartoon rendering and a "type-as-you-find" workspace finder.

Notice that it is also possible to upgrade trial licenses as long as they are still valid.

Download latest version here (requires login).

Work in progress...

The following items highlight work in progress that will be available in future MVD releases:

• Optimized docking search algorithm: We are currently working on improvements of the docking search algorithm to make it faster and more efficient when working with very flexible ligands.
• QSAR: We are working on a 2D-QSAR extension that will make it possible to construct QSAR models from a set of imported descriptors. The QSAR model can be used to prescreen a large set of compounds before docking the most promising candidates.
• Displaceable water model: We are also working on a displaceable water model enabling the ligands to automatically displace structural water molecules during the docking simulation.

More information about MVD...