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Molegro Virtual Docker 2010 v4.1.0

Molegro Virtual Docker is an integrated platform for predicting protein – ligand
interactions. It handles all aspects of the process, from preparing the molecules to
determining the potential binding site of the target protein, and predicting the binding
mode of the ligand.
Molegro Virtual Docker offers high-quality docking based on a novel optimization
technique combined with a user interface experience focusing on usability and
Molegro Virtual Docker at a Glance
High docking accuracy: the docking
Easy-to-use interface: the built-in
engine has been proven to correctly
wizards enable the user to easily setup
identify binding modes with high
and perform docking runs. Advanced
accuracy (see next page).
visualization and analysis tools are
provided to examine ligand-receptor
Versatile features including induced fit
interactions and fine-tune found
docking (sidechain flexibility), ligand-
docking solutions.
based screening based on structural
similarity, flexible alignment of small
Cross-platform: supported on Linux,
molecules, and regression model
Windows, and Mac, allowing easy
building using neural nets or MLR.
interoperability between platforms.
product:Molegro Virtual Docker 2010 v4.1.0
Size:24 MB