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LIAC at EPFL Profile
LIAC at EPFL

@SchwallerGroup

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Laboratory of Artificial Chemical Intelligence at @EPFL | led by @pschwllr | AI-accelerated discovery and synthesis | part of @NCCR_Catalysis | team-run account

Lausanne, Switzerland
Joined October 2021
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@SchwallerGroup
LIAC at EPFL
11 months
Word of the day: 'WOMEN'. Our mothers, grandmas, sisters, aunts, girlfriends, daughters, mentors, leaders, teachers, scientists, engineers, artists, activists who raise, inspire and lead. We stand in awe of their strength and tenderness. Here's to WOMEN, every day, everywhere! ๐Ÿ’
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@SchwallerGroup
LIAC at EPFL
11 months
Can you decode our special message? ๐Ÿ•ต๏ธโ€โ™€๏ธโœจ P. S. HAPPY INTERNATIONAL WOMEN'S DAY to all the inspiring women out there! ๐Ÿ‘ฉโ€๐Ÿ”ฌ๐Ÿ‘ฉโ€๐ŸŽจ๐Ÿ‘ฉโ€๐Ÿณ๐Ÿ‘ฉ๐Ÿฟโ€๐Ÿ’ป๐Ÿ‘ฉโ€๐ŸŒพ๐Ÿ‘ฉโ€๐Ÿš€๐Ÿ‘ฉ๐Ÿปโ€โš–๏ธ๐Ÿ‘ฉโ€โœˆ๏ธ๐Ÿ’ƒ๐Ÿพ๐Ÿ‘ฉโ€โš•๏ธ๐Ÿ‘ฉโ€๐Ÿญ๐Ÿง“๐Ÿผ๐Ÿฆธ๐Ÿฝโ€โ™€๏ธ๐Ÿงšโ€โ™€๏ธ๐Ÿคธโ€โ™€๏ธ๐Ÿ‘ท๐Ÿพโ€โ™€๏ธ๐Ÿ‘ฉ๐Ÿผโ€๐ŸŽค๐Ÿ‘ฉโ€๐ŸŽ“๐Ÿ‹๏ธโ€โ™€๏ธ๐Ÿ‘ฎโ€โ™€๏ธ๐Ÿ„๐Ÿพโ€โ™€๏ธ๐Ÿ‘ฉโ€๐Ÿซ๐Ÿ‘ฉ๐Ÿฝโ€๐Ÿ’ผ P. P. S. Don't *see* the answer?๐Ÿ‘€ DW, our prof struggled too ๐Ÿ˜‚@pschwllr #EPFL #EPFLChem #InternationalWomensDay
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@SchwallerGroup
LIAC at EPFL
7 days
RT @lnce_epfl: Great collaboration with @SchwallerGroup ! Congratulations to the BoLudo team ๐Ÿ‘ and looking forward to what comes next :) @Eโ€ฆ
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@SchwallerGroup
LIAC at EPFL
29 days
RT @rneschneuing: Our paper on computational design of chemically induced protein interactions is out in @Nature. Big thanks to all co-authโ€ฆ
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@SchwallerGroup
LIAC at EPFL
1 month
RT @GWellawatte: Finally our XpertAI paper is published in Nature Comm Chem!๐Ÿงช This work shows how explainable AI can be used for hypothesisโ€ฆ
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@SchwallerGroup
LIAC at EPFL
2 months
RT @LcsoLab: It was time for the end-of-year update of our useful link website!
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@SchwallerGroup
LIAC at EPFL
2 months
RT @pschwllr: Back from a short and intense #NeurIPS2024, it was great meeting old friends and making new ones, celebrating 5 years of RXNMโ€ฆ
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@SchwallerGroup
LIAC at EPFL
2 months
Congrats to the whole team (@JeffGuo__, @VictorSabanza, @GWellawatte, Alex, Matt, @drecmb, @maglederb, Huixuan, Victoire, Marta, @kelmannson)! Amazing to see such impactful work across molecular design, knowledge graphs, and chemistry QA. Follow @SchwallerGroup to stay updated!
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@SchwallerGroup
LIAC at EPFL
2 months
RT @d_armstr: 1/ Starting material constrained synthesis planning is now possible using a general retrosynthesis algorithm *without* traiโ€ฆ
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@SchwallerGroup
LIAC at EPFL
2 months
Another great #Ellis workshop on ML for Molecular Discovery. Thanks to @gklambauer, @fra_grisoni, and the whole organizing team! Proud of our team's contributions - 3 posters (@d_armstr, @kelmannson, @ZJoncev) and an excellent talk by @SarinaKopf! Very well done! #compchem
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@SchwallerGroup
LIAC at EPFL
2 months
RT @gklambauer: The Machine Learning for Molecules workshop 2024 will take place THIS FRIDAY, December 6. Tickets for in-person participaโ€ฆ
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@SchwallerGroup
LIAC at EPFL
2 months
RT @ArdemisPrime: Congratulations to AI celebrity @pschwllr on rocking the SNSF starting grant! Big things are about to happen @SchwallerGโ€ฆ
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@SchwallerGroup
LIAC at EPFL
2 months
RT @EPFL_AI_Center: ๐ŸŽ‰ย Four of our faculty members have been awarded the prestigious Swiss National Science Foundation SNSF "Starting Grant"โ€ฆ
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@SchwallerGroup
LIAC at EPFL
2 months
Join the team โฌ‡๏ธ #chemtwitter #mljobs #chemjobs
@pschwllr
Philippe Schwaller (he/him)
2 months
We are hiring (resharing appreciated)! Given a few recent successful grant applications (I got my SNSF Starting Grant ๐Ÿš€), we are extending the LIAC (@SchwallerGroup) team and have multiple openings (PhD/postdoc) for 2025. Are you interested in #AI4Science and machine learning with real-world applications in chemistry? Apply now (deadline: December 20th) by filling in the following form: Interviews with selected candidates will take place in January/February. We offer a highly dynamic and collaborative environment with competitive salaries ( and benefits (. We strongly encourage candidates of all different backgrounds and identities to apply. Each new hire is an opportunity for us to bring in a different perspective, and we are always eager to further diversify our team. Check out
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@SchwallerGroup
LIAC at EPFL
3 months
RT @zdeborova: Join one of the strongest communities in AI in Europe. Call for applications for postdoc fellowships in all AI-related areasโ€ฆ
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@SchwallerGroup
LIAC at EPFL
4 months
RT @VictorSabanza: 1/ ๐Ÿงช๐Ÿ’ก Curious about faster material & molecular discoveries? Multi-fidelity Bayesian Optimization (MFBO) is your friend!โ€ฆ
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@SchwallerGroup
LIAC at EPFL
4 months
RT @RebeccaNeeser: FSscore has now been published in Chemistry-Methods (@ChemEurope)! ๐Ÿš€ Check out the updated paper on personalized synthesโ€ฆ
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@SchwallerGroup
LIAC at EPFL
4 months
RT @pschwllr: Would it not be nice to be able to enforce building blocks in the synthesis routes of generated de novo molecules? To overcโ€ฆ
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@SchwallerGroup
LIAC at EPFL
4 months
RT @JeffGuo__: General-purpose (without any constraints) molecular generative models can *directly* optimize for *constrained* synthesizabiโ€ฆ
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