🧪 AI is revolutionising computational chemistry - but what does that look like in practice?

Join @franmartinm.bsky.social (@kingsnmes.bsky.social) on 19 Nov as he shares cutting-edge research on using AI to model nature-inspired sustainable materials.

Sign up ⬇️ www.kcl.ac.uk/events/compu...

Amazing days in #Atlanta at the #SocietyOfEngineeringScience meeting. Nostalgic about the family we had at @mit.edu with Zhao Qin, @jingjieyeo.bsky.social, Anna Tarakanova and Grace Gu… and learning the last insights form our supervisor back then, @profbuehlermit.bsky.social. What a come back to US

Back in Boston for moderating a panel on “Governing the Machine” at the 50th aniversary of the @tppmit.bsky.social with @marzyehghassemi.bsky.social, Cecilia Testart, Nathaniel Fruchter and Prof David D. Clark (one of the pioneers of internet!!). So thought-provoking… #ai #policy @mit.edu

Nice to speak at the European Conference of Theoretical and Computational Chemistry in Naples surrounded by friends. Great opportunity to present our work at @kingscollegelondon.bsky.social @kingsnmes.bsky.social and Swansea University collaborating with @rgblabmit.bsky.social

Dr Martin-Martinez draws inspiration from nature to design sustainable materials, such as self-healing roads. Joining King's as part of a major investment in science, he unites expertise in chemistry, engineering and AI.

www.kcl.ac.uk/meet-dr-fran...

#ScienceAtKings @kingsnmes.bsky.social

ML is accelerating #MaterialsDiscovery but it is energy-intensive. Emilio Nuñez Andrade strikes again this summer with #eMFP, a #MolecularRepresentation that improves performance and supports #sustainable and #scalable #MachineLearning. Pre-print: doi.org/10.26434/che...

It was great to participate on this!

Lessons learned from Nature on #Superhydrophobic and #Superoleophobic Surfaces. Shout out to Cerys Cormican and Sinem Bektaş. Glad to work with Shirin Alexander on this, with the support of Concha Bosch and Begoña Ruiz from #AINIA doi.org/10.1002/adma... #sustainability #bioinspired #biomimicry

Can we find more efficient ways to encode chemical structures into computer-readable formats? Emilio's work is out in #DigitalDiscovery. With @isvida.bsky.social et al. across @kingsnmes.bsky.social, #SwanseaUniversity, @mitofficial.bsky.social and #UniversityofGranada pubs.rsc.org/en/content/a...

New self-healing asphalt could heal cracks in the road in less than an hour.

A wheely great research collaboration between @franmartinm.bsky.social, Swansea University and Google Cloud paves the way for more sustainable roads. 🚗
www.kcl.ac.uk/news/self-he...

Glad to work with @googlecloudsec.bsky.social at @kingscollegelondon.bsky.social. In collaboration with Jose Norambuena-Contreras, at #SwanseaUniversity. #ComputationalChemistry #AI #supercomputing #biobased #selfhealing #asphalt #sustainable @kingsnmes.bsky.social

Open #postdoc position in *Organic/Medicinal Chemistry* for generative #AI in Drug Discovery — join us @tueindhoven.bsky.social 💪🏻

Funded by the European Research Council (ERC).
Deadline: Jan 15, 25

jobs.tue.nl/nl/vacature/...

Repost appreciated!

Excited to announce the release of our preprint, "The Martini 3 Lipidome: Expanded and Refined Parameters Improve Lipid Phase Behavior", now available on @chemrxiv.bsky.social

👉 Read the full preprint here: chemrxiv.org/engage/chemr...

PhD opportunity on Computational modelling of biobased materials from biomass degradation at King’s College London www.findaphd.com/phds/project...

I had the great pleasure of coordinating our annual "35 challenges in materials science". Was super fun to organise and engage with all these brilliant scientists!

Take a look at what this year's cohort of materials scientists are working on!

#Matter

www.cell.com/matter/abstr...

Hello 🦋 world and hello #ChemSky #BlueSci #AISky #MLSky…