A tool to develop QSAR/QSPR Deep machine learning models. DeepMolecularNetwork provide a framework to build models with:
- threedimensional voxel data
- smiles strings
- tabular values (i.e. molecular descriptors)
Soon example will follows... stay tuned!
September 2019 - First online release
DeepMolecularNetwork 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"
DeepMolecularNetwork is written and maintained by Giuseppe Marco Randazzo grandazzo@gmail.com
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Please if you use this for commercial please send me a mail with your logo Acknowledge the github page and the author in your application. If you use for academic research please cite the original GitHub repository.