Our contribution to the XXIII. Meeting of Biochemists and Molecular Biologists
The traditional Czech conference XXIII. Meeting of Biochemists and Molecular Biologists took place from 12th to 13th November 2024 in the Hotel Continental in Brno.
The thesis first focuses on existing empirical methods for partial atomic charge calculation and their implementation in the Atomic Charge Calculator II web server, with some of the methods being implemented there for the first time ever. The next part of the thesis introduces the SQE+qp, an empirical method for partial atomic charge calculation with cutting-edge quality results for proteins. This advantage of the SQE+qp method is utilised in the αCharges web server presented in the final part of the thesis. Charges provides the ability to automatically protonate any protein in the AlphaFold DB and compute the protein's partial atomic charges that are useful for further research.
Congratulations, Ondřej!
The traditional Czech conference XXIII. Meeting of Biochemists and Molecular Biologists took place from 12th to 13th November 2024 in the Hotel Continental in Brno.
On 7 November 2024, Ondřej Schindler from the Structural Bioinformatics group received the Masaryk University Vice-Rector's Award for Excellence in Doctoral Studies.