Ramon Crehuet
rcrehuet.bsky.social
Ramon Crehuet
@rcrehuet.bsky.social
Protein dynamics and protein design. But so far only with a computer... Yes I'm happy to rely on excellent collaborators who do the dirty work! :-)
We also compare the proton coupled electron transfer between between CH3SOH and CH3SSH as they have the same number of valence electrons.
This work has been published in @pccp.rsc.org Here is the article:
doi.org/10.1039/D4CP...
The Reaction of Sulfenic Acids with OH and HO2 Radicals in different Environments.
Sulfenic acids are involved in major chemical processes occurring in the atmosphere, in food chemistry and in biological systems. In these diverse environments, oxidation reactions caused by reactive ...
doi.org
April 7, 2025 at 8:52 AM
Using high level QM methods we find that the abstraction of the acidic hydrogen by OH or HO2 is the most important process. In many cases the processes are diffusion controlled.
April 7, 2025 at 8:52 AM
This is not a failure. Im sure aniline shakes this way when that music sounds!
March 28, 2025 at 10:40 AM
The latter are less flat than those of IDPs 😅
February 21, 2025 at 8:16 PM