opengrowth to run in linux online online with Winfy

We have hosted the application opengrowth to run in linux online in order to run this application in our online workstations with Wine or directly.


Quick description about opengrowth to run in linux online:

OpenGrowth is a research program which grows new ligands in proteins by connecting small organic fragments. The details can be found in the original publication "OpenGrowth: an automated and rational algorithm for finding new protein ligands" (J. Med. Chem., http: //dx.doi.org/10.1021/acs.jmedchem.5b00886).

To use OpenGrowth, you will need OpenGrowth_1.0.zip and Resources_1.0.2.zip that can be found by clicking on the Files menu in the horizontal bar at the top (https: //sourceforge.net/projects/opengrowth/files). OpenGrowthGUI, FOG2.0, and the 3Mer-Screen stand-alone can be found in OpenGrowth_1.0.zip. To prepare new fragments you need BuildingFragments_1.0.1.zip and the scripts for MD simulations are in MD-Scripts_1.0.1.zip. SMoG2016.tar.gz allows to compute a score with the newly developed function (J. Chem. Inf. Mod., http: //pubs.acs.org/doi/abs/10.1021/acs.jcim.6b00610).

For any questions, please send emails exclusively at opengrowth-discuss@lists.sourceforge.net.

Features:
  • Drug design


Audience: Healthcare Industry, Science/Research, End Users/Desktop.
User interface: Qt.
Programming Language: C++.

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