MolecularFramework
MolecularFramework is a c/c++ cheminformatic 3D modeling library to speed up drug discovery.
| Conformer Aligment |
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| Pharmacophore Superposition | VDW Shape Superposition |
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| Electrostatic Potential | |
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3D visualizations made using VMD http://www.ks.uiuc.edu/Research/vmd/
Changelog
- September 2019: First online release
- December 2012: Starting the development
License
MolecularFramework is distributed under GPLV3 license in the hope that it will be useful, but WITHOUT ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU General Public License for more details.
To know more in details how the license work please read the file "LICENSE" or go to "http://www.gnu.org/licenses/lgpl-3.0.html"
MolecularFramewrok is written and maintained by Giuseppe Marco Randazzo grandazzo@gmail.com
Documentation
TODO
Cite/Acknowledgements
Please if you use this for commercial please send me a mail with your logo. If you use for academic research please cite the original GitHub repository.