When do constant-charge and constant-potential (CP) simulations actually agree?
Super proud to share our latest work led by @ConorBrennan at @CCEM_Group & @TCD_Chemistry with Dr. Didac A. Fenoll @energigune_brta! 👏
https://t.co/EzWBhpySHy
Our supervisor @MGarcia_Melchor was featured on the TV news (Tele 7 en directo) discussing on how computational and experimental chemistry @ReisnerLab are coming together to transform drug functionalisation in pharma🧑🔬
Starting at 1:00:00 in the news
https://t.co/Qadk7oUsRB
Our supervisor @MGarcia_Melchor was featured on the TV news (Tele 7 en directo) discussing on how computational and experimental chemistry @ReisnerLab are coming together to transform drug functionalisation in pharma🧑🔬
Starting at 1:00:00 in the news
https://t.co/Qadk7oUsRB
Excited to see our new paper out in @NatureSynthesis! Another fantastic collaboration with the @ReisnerLab reporting a new strategy for C–H alkylation. A discovery that started from a serendipitous observation and led to a really nice story!
https://t.co/ZXzP4BYl2g
We are thrilled to share the new @NatureSynthesis work of @MantingMu and @TimoSommer_ together with the @ReisnerLab on a new synthetic strategy for C–H alkylation of electron-poor aromatics! Thanks also to @MGarcia_Melchor for all the supervision!
https://t.co/Mt30fRPfhS
Congrats to @MantingMu for winning the 1st prize at the @TCD_Chemistry BOC Gases Award for her recently defended PhD thesis in our group! And congrats also to an excellent presentation of her latest research! 🫢
Big birthday week at @CCEM_Group! 🎉 Happy birthday to Cian and Ale, two brilliant humans who make our science (and days) better. Wishing you both a fantastic year ahead! 🥳🎂
Upgrading Sodium-Mediated Deprotonative Borylation to Catalytic Regimes: Regioselective Control and Mechanistic Implications | Journal of the American Chemical Society @EvaHeviaGroup@DCBPUnibern @energigune_brtaand @TCD_Chemistry@CCEM_Group https://t.co/VZN3NjIfnQ