Volker Deringer

Can we “design” amorphous materials with useful properties? In a Perspective in @NatRevMater, we argue that #compchem and AI are bringing us closer towards this ambitious goal. Thank you @YuanbinLiu2, Ata, @SodeAndy, & @thesiminegroup! 🙂 Read more here: rdcu.be/d3JD6

Superb work by John! Follow him at @jla_gardner to read about his open-source software & science for ML interatomic potentials #compchem @VLDGroupOx @OxfordChemistry

@RS_Chemist @cecamEvents @sven_rogge @tristanbereau @CelineM35 @MarbachSophie @EdoBoek @SouzaPauloCT Thank you again for the invitation, and thank you to everyone for inspiring #compchem discussions! 🙂

We had an awesome @cecamEvents workshop on Bridging modeling scales at Montpellier! Thanks to all speakers, including @sven_rogge @vl_deringer @tristanbereau @CelineM35 @MarbachSophie @EdoBoek @SouzaPauloCT and to Romain Dupuis and Jorge Dolado for being the best co-organizers

@DehnenStefanie Thank you, and likewise!! 🙂

It was great meeting you again - and listening to your excellent lecture! Hope to catch up soon!

Had a wonderful time in Munich at the @GDCh_aktuell Conference on Inorganic Chemistry! Great discussions with colleagues & students. And a distinct honour to give one of the plenary lectures, alongside @DehnenStefanie @EvaHeviaGroup @Janek_Lab_JLU @CLuChem and others 🤩

Profs @vl_deringer and @fjduarteg have both been busy hosting a Faraday Discussions meeting in Oxford! "Data-Driven Chemistry": exploring #ML and #AI for chemical discovery. You can read about it here: chem.ox.ac.uk/article/farada… @OxfordChemistry @TrinityOxford @Faraday_D #FD_Data

Just finished responding to my last batch of questions (I think) on LPMs for the Faraday Discussion on data driven chemical discovery that was held at Oxford. This was one of the best meetings that I have attended in a long time. The format is wonderful. The cost you pay is that you need to plan ahead and submit a paper, but the rewards in high-level discussion and interactions are worth it. #FD_DATA, #Loving_cup.

Kudos to the committee @MolecularXtal @vl_deringer @foo_fighterin @fjduarteg for such a great workshop. Super impressed by the speakers line up, quality of the papers #FD_data and 'right amount' of enthusiasm in discussions. And still feeling inspired by @A_Aspuru_Guzik's talk!

A busy week for the group, presenting some of our work and helping with the organisation of the @Faraday_D meeting in Oxford #FD_Data. We hope everyone enjoyed the scientific discussions as much as we did!

@JiayunPang @Ahmedzaytoun145 Thank you @JiayunPang and @Ahmedzaytoun145 for joining us!!

PhD student @Ahmedzaytoun145 presented his poster on predicting selectivity of C-H functionalization at the Faraday discussion on data-driven discovery in the chemical sciences at Oxford. Lots of interesting exchange of ideas (and one of the best conference dinners)! #FD_Data

Chris Taylor presented his work on applying crystal structure prediction at large scale (1000+ molecules) in yesterday's session on Discovering Trends in Big Data at #FD_Data in Oxford. Lots of great discussion at this meeting. (the paper is here: pubs.rsc.org/en/content/art…)

It’s been great to present a poster for the first time at the Faraday Discussion on Data-driven discovery in the chemical sciences! Heard such great ideas and comments and am excited for what’s to come #FD_Data

@grynova_CCC @fjduarteg @Faraday_D Please do visit us!! 😀 Hope all is well in Birmingham!

@vl_deringer @fjduarteg @Faraday_D I’m sorry for missing what looks like an awesome meeting - I promise to visit soon!

A key idea behind #FD_Data was to build new connections between the molecular and materials #compchem communities – and so it’s jointly chaired by @fjduarteg & myself. Super excited to now see this idea become reality 😀 @Faraday_D

@fiszczyp @fjduarteg @Faraday_D Thank you for taking it (should have tagged you yesterday!) – and super nice to meet in person and talk! 😀

@vl_deringer @fjduarteg @Faraday_D Great photo! 😊

@eMenkah @A_Aspuru_Guzik There’ll be a written record – to be published soon in @Faraday_D journal!

@vl_deringer @A_Aspuru_Guzik Can this talk be accessed anywhere please? I would love to listen to it.

Inspiring opening lecture & advice for students in the field by @A_Aspuru_Guzik at #FD_Data. Thank you for joining us! #DigitalChemistry #compchem

@VahidehAlizadeh @A_Aspuru_Guzik There will be a written record – in the @Faraday_D volume for this meeting – watch this space! 😀

@vl_deringer @A_Aspuru_Guzik Hope there is a record of this talk, is it?

Second day at #FD_Data – the morning session explores “Discovering structure–property correlations” (speaking here is @JelfsChem) #compchem #DigitalChemistry @Faraday_D