Chemical reactions
Transition state in the cis-trans isomerization of retinal
Image Credit: S. Ghysbrecht, B.G. Keller "Thermal Isomerization Rates in Retinal Analogues using Ab-Initio Molecular Dynamics" J. Comput. Chem. (2024), 45, 1390-1403
- S. Ghysbrecht, L. Donati, B.G. Keller "Accuracy of reaction coordinate based rate theories for modelling chemical reactions: insights from the thermal isomerization in retinal" arXiv (2023) https://doi.org/10.48550/arXiv.2312.12948
- S. Ghysbrecht, B.G. Keller "Thermal Isomerization Rates in Retinal Analogues using Ab-Initio Molecular Dynamics" J. Comput. Chem. (2024), 45, 1390-1403. https://doi.org/10.1002/jcc.27332
- M.N. Trung, S. Kieninger, Z. Fandi, D. Qiu, G. Liu, A. Saiardi, H. Jessen, B. Keller, D. Fiedler "Stable isotopomers of myo-inositol to uncover the complex MINPP1-dependent inositol phosphate network" ACS Cent. Sci. (2022) 8, 1683-694. https://doi.org/10.1021/acscentsci.2c01032