• Seminar

Prediction of absorption maximum of substituted porphyrins and metalloporphyrins

Please enter SMILES
http://chem-predictor.isc-ras.ru/app/uploads/2024/03/2.3.-porphyrins.mp4

If you are using the model in your research, please cite:

Bichan, N. G., Ovchenkova, E. N., Ksenofontov, A. A., Mozgova, V. A., Gruzdev, M. S., Chervonova, U. V., … & Lomova, T. N. (2022). Meso-carbazole substituted porphyrin complexes: Synthesis and spectral properties according to experiment, DFT calculations and the prediction by machine learning methods. Dyes and Pigments, 204, 110470.

For all technical questions: Mikhail Lukanov, George Sysuev
Laboratory head: Alexander Ksenofontov