Ali Goodfellow
@ali_goodfellow
PhD student in the Bühl group at the University of St Andrews 🏴 Using DFT to study homogeneous catalysis 🖥️ #compchem
ID: 4104977253
03-11-2015 14:12:44
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Finally, we congratulate our prize winners: Annabel Flook, Izzy Hehir, Ben Rhodes, Astrid Berge, Ben Honoré, and Ananya Singh
Happy to share this article from our group (James Luk, Nachiket) in collaboration with Michael Buehl, Ali Goodfellow St Andrews School of Chemistry now online on ChemRxiv on making polyureas and polyurea-urethanes using Ru #pincer catalysts. See here: chemrxiv.org/engage/chemrxi…
The final version of 3DReact (née EquiReact) is out! Here: pubs.acs.org/doi/10.1021/ac…. Ksenia Briling Charlotte Bunne Vignesh Ram Somnath Rubén Laplaza Andreas Krause clemence corminboeuf NCCR Catalysis ! vs the preprint, discussion on InReact vs EquiReact: do we need equivariance for current rxn datasets?
After a long journey, extremely happy to see Zhang Hanwen and Veronika Juraskova's work on MLPs in Nature Communications! 🎉 Check this blog summarising how this training approach facilitates modelling chemical reactions in solution communities.springernature.com/posts/modeling… Oxford Chemistry #compchem
Synthesis of Tetra-Substituted 3-Hydroxyphthalide Esters by Isothiourea-Catalysed Acylative Dynamic Kinetic Resolution (Andrew D. Smith and co-workers) Andrew Smith Shubham Agrawal Ali Goodfellow St Andrews School of Chemistry #openaccess onlinelibrary.wiley.com/doi/10.1002/an…
