Welcome to the Gohlke Group

Computational Pharmaceutical Chemistry and Molecular Bioinformatics

 

CPCLab wishes all of you Happy Holidays.


12/23: The PHOENIX Pharmazie Wissenschaftspreis 2023 in Pharmaceutical Chemistry

was awarded for the publication

Bhatia, S.*, Spanier, L., Bickel, D., Dienstbier, N., Woloschin, V., Vogt, M., Pols, H., Lungerich, B., Reiners, J., Aghaallaei, N., Diedrich, D., Frieg, B, Schliehe-Diecks, J., Bopp, B., Lang, F.,  Gopalswamy, M., Loschwitz, J., Bajohgli, B., Skokowa, J., Borkhardt, A., Hauer, J., Hansen, F.K., Smits, S.H.J., Jose, J., Gohlke, H.*, Kurz, T.*
Development of a first-in-class small molecule inhibitor of the C-terminal Hsp90 dimerization. 

ACS Cent. Sci. 2022, 8, 636–655.


10/25: Two grants for computing time on JUWELS, Juelich Supercomputing Center, have been approved, for molecular simulations and data science.

The proposal "Structural dynamics of apo, agonist- and antagonist-bound full-length ETR1" has been awarded the John von Neumann Institute for Computing (NIC) Excellence Award 2023/1. Read more here.