Adrian Dobbelstein @adobbelstein.bsky.social PhD student @EPFL🇨🇭 (LPDI) & Adjunct PhD Student at AITHYRA 🇦🇹
ML for Drug Discovery
Craig M. Crews @craigmcrews.bsky.social 
Marta Skreta @martaowesyou.bsky.social UofT CompSci PhD Student in Alán Aspuru-Guzik's #matterlab and Vector Institute | prev. Apple
John Steele @jfcsteele.bsky.social Structural biologist and biochemist with an interest in synthetic biology for green chemistry. Unapologetic geek passionate about science and biotechnology.
Postdoc at Edinburgh University- all views are my own. He/Him.
Chence Shi @chenceshi.bsky.social CS PhD Mila
Sergey Ovchinnikov @sokrypton.org Scientist, Assistant Professor at MIT biology, #FirstGen
Emile van Krieken @handle.invalid Assistant professor @ VU Amsterdam, prev University of Edinburgh.
Neurosymbolic Machine Learning, Generative Models, commonsense reasoning
https://www.emilevankrieken.com/
Alexandros @alexandrosangeli.bsky.social 🍉 🕊️
Informatics PhD @ University of Edinburgh
Panagiotis Antoniadis @panosantoniadis.bsky.social ELLIS PhD Student in the Department of Biology at the University of Copenhagen. AI for biology. https://panosantoniadis.github.io/
Alice Wicks @ubch-alice.bsky.social Postdoc researching ubiquitin biology @fletcherlab.bsky.social @CVR in the context of viral infection. Equality, Diversity, and Inclusion (EDI) Advocate. What I say here is my personal opinion.
X: UbcH_Alice
thefletcherlab.co.uk
Bill Irwin - NZ @billirwinnz.bsky.social I’m a (mostly) retired rural photographer living in Christchurch, New Zealand.
Farmer in a former life. Now photographing for fun.
www.billirwin.nz
Viet Nguyen @vietngth.bsky.social PhD Student at Würzburg
Science HR @sciencehr.bsky.social A career network featuring science jobs in academia and industry.
Visit our platform at www.science.hr
Lukas Sigmund @lukasmsigmund.bsky.social PostDoc @ AstraZeneca | Computational Chemistry and Machine Learning
Ian Dunn @ian-dunn.bsky.social PhD Candidate in Computational Biology @ University of Pittsburgh. Working on deep generative models for molecular structure. iandunn.io
Patrick McGahon @paadzer.bsky.social Irish gay guy in the East of England 🏳️🌈
In my fifties
EastEnders & Bargain Hunt fan
RIP mum 💔 2022
Worked at Cambridge University & NHS
Awful at responding to DMs
Sober a few years
Not looking for hookups or onlyfans subscriptions
Digital Discovery @digital-discovery.rsc.org A new #GoldOA journal from @roysocchem.bsky.social, meeting the trend towards greater automation and data-driven scientific techniques head-on. Led by EiC Alan Aspuru-Guzik
🌐 Website: rsc.li/digitaldiscovery-journal Published by @rsc.org
MedChemDan🧪🤖 @medchemdan.bsky.social Automated medicinal chemist, flow chemist and general technology geek 🤓👨🔬🤖🧪🇬🇧🇸🇪
Sarah Gurev @sarahgurev.bsky.social FutureHouse Fellowship - Sergey Ovchinnikov and Aaron Schmidt labs! Previously MIT EECS PhD with Debora Marks. Talk to me about modeling viral/immune proteins! 🦠
Moa Johansson @moajohansson.bsky.social Professor in AI at Chalmers University of Technology. Neuro-symbolic AI, AI for maths, a bit of NLP and a dash of cognitive science.
Geoff Hutchison @geoffhutchison.net Chemist, Scientist, Husband, Dad, Runner, Teacher. I develop Avogadro + OpenBabel to find new materials for energy applications @Pitt_Chemistry he/him
Reza Rezvan @rzvan.bsky.social phd @ Chalmers doing {mas, marl, risk, uncertainty}
prev. {@CityUHongKong, @ericsson, @Huawei}
https://rezarezvan.com
Arne Schneuing @rne.bsky.social PhD student @EPFL 🇨🇭
ML & computational biology 🤖🧬⚛️
Fredrik K. Gustafsson @fregu856.bsky.social Postdoc at AstraZeneca in Cambridge. Machine learning in medicine.
https://www.fregu856.com/
Dominic Tyer @dominic-tyer.bsky.social Senior Editor | GlobalData Healthcare
https://www.globaldata.com/industries/pharmaceutical
Christopher Ing @jsci.bsky.social Co-founder (https://www.proteinqure.com/), Toronto-based (🇨🇦), biophysicist (💻), peptide drug designer (💉), programmer (🐍), DJ (🎶), fan of felines (🐈). Are you looking for a job in drug discovery in Canada? DM me.
Austin Tripp @austinjtripp.bsky.social (ML ∪ Bayesian optimization ∪ active learning) ∩ (drug discovery)
Researcher @valenceai.bsky.social
Details: austintripp.ca
Tomáš Pluskal @pluskal-lab.org Group Leader at the Institute of Organic Chemistry and Biochemistry (IOCB Prague @iocbprague.bsky.social). Plant biochemistry, metabolomics, genomics, bioML, etc. https://www.pluskal-lab.org
Marloes Arts @artsmarloes.bsky.social Member of Technical Staff @ CuspAI
Previously PhD+postdoc @ KU | intern @ MSR | scientist @ Genmab
Interested in everything ML and molecules / materials
Janosch Menke @janoschm.bsky.social ML and Cheminformatics Research Engineer at deepmirror
Samuel Kaski @samikaski.bsky.social Probabilistic machine learning and its applications in AI, health, user interaction.
@ellisinstitute.fi, @ellis.eu, fcai.fi, @aifunmcr.bsky.social
Rocío Mercado Oropeza @rociomer.bsky.social Assistant professor in Data Science and AI at Chalmers University of Technology | SciLifeLab Group Leader | PI for AI lab for Molecular Engineering (AIME) | ailab.bio | rociomer.github.io
Chemical Science @chemicalscience.rsc.org Flagship journal for @rsc.org. Open access, all topics in chemistry. chemicalscience-rsc@rsc.org 🌐 Website: rsc.li/chemscience
Maria Nuria Peralta-Moreno @peraltamnuria.bsky.social ⚛️👩🔬 Chemistry, in theory 👩🔬⚛️
TCCM PhD student at the IQTCUB
💊 Modelling of Biological Systems and Drug Design Research Group at the UB 💊
RAGE-KG 2026 @rage-kg.bsky.social RAGE-KG (Retrieval-Augmented Generation Enabled by Knowledge Graphs) is an established academic workshop targeting synergies between #KGs, #RAG and #LLMs, coming to #ISWC 2026 in Bari, Italy 🇮🇹.
CfP: https://rage-kg.org
Connect and share on Bluesky ☀️
Lukhmanul Hakeem K. @lukhmanulhakeemk.bsky.social Computational chemist 🖥️ ⌬👩🏻🔬🧬 | Fifth-year i2 BS-MS Student |
IISER TVM
David Nordström @davnords.bsky.social Phd Student @ Chalmers
Deep Learning for Computer Vision.
Strengthen your ViTs: https://github.com/davnords/octic-vits
Sébastien Darses @sebdarses.bsky.social Act. Int. Agent? (Math. Assoc. Prof., on leave)
Research: Prob / Stat / Ant
Teaching Project (non-profit): https://highcolle.com/
https://sites.google.com/view/sebastien-darses/research?authuser=0
Thomas Löhr @tlhr.bsky.social Head of Compute / Co-founder @bindresearch.org | Simulations, Drug Design, Disordered Proteins
Janani Durairaj (Jay) @ninjani.bsky.social Deep learning for protein structure, interactions and design. University of Lausanne
https://pickybinders.org
Society for Medicines Research @socmedres.bsky.social The Society for Medicines Research is a UK based charity connecting scientists engaged in drug discovery. We organise scientific mentoring events.
https://smr.org.uk
@salv888.bsky.social @salv888.bsky.social 
Andrea Scarpino @andreascarpino.bsky.social Lead Computational Chemist at The Institute of Cancer Research.
📍 London, UK
#compchem #cheminformatics #drugdiscovery
Daniel Alvarez @daninthenet.bsky.social Senior Drug Designer | #AI Computational Medicinal Chemist | #medchem + #compchem | Also into #pottery and #oilpainting- C @chma.bsky.social @chma.bsky.social
Todger1 @todger1.bsky.social 
Ahana (she/her) @ahana.bsky.social Reinforcement Learning PhD student, UPF Barcelona.
Uncertain in the face of optimism.
ahanadeb.com
Christian A. Naesseth @canaesseth.bsky.social Assistant Professor of Machine Learning
Generative AI, Uncertainty Quantification, AI4Science
Amsterdam Machine Learning Lab, University of Amsterdam
https://naesseth.github.io
Edvin LZ @edvinli.bsky.social Senior ML Research Scientist and Engineer, PhD
📍Göteborg
https://edvinli.github.io
CMcG Rheum @medicastra.medsky.social #Hospital, #MD, #Rheumatology, UK based.
A chemistry PhD & pharma bg, came to medicine late
Scrolling is a distraction from taking action. Pick some concrete way to help & get to it.
@twofishnocat.bsky.social for the likes/hobbies stuff
Michael Kevin Spencer @aisupremacy.bsky.social Canadian in Taiwan. Emerging tech writer, and analyst with a flagship Newsletter called A.I. Supremacy reaching 115k readers
Also watching Semis, China, robotics, Quantum, BigTech, open-source AI and Gen AI tools.
https://www.ai-supremacy.com/archive
Jeff Guo @jeff-guo.bsky.social PhD student at EPFL working on generative molecular design | Previously Microsoft AI4Science and AstraZeneca
Juan Viguera Diez @viguera10.bsky.social PhD student at AstraZeneca and Chalmers University of Technology. Machine Learning for natural sciences (Drug discovery).
Karina Pikalyova @karinapikalyova.bsky.social PhD in #chemoinformatics from the University of Strasbourg, passionate about de novo design of biologics and small molecules #AI #peptides #AMR #compchem #bioinfo 🧬🧫🧪💊
Currently a Research AI Engineer for chemistry
Views are my own
Weilong Chen @weilong30.bsky.social PhD Student @TU_Muenchen Previous @TheDPTechnology | @chalmersuniv | @VolvoGroup | BSc. NUDT 18'
https://weilong-web.github.io
Paul Häusner @paulhausner.bsky.social Learning to optimize | graph neural networks | AI 4 science
PhD student at Uppsala University | Research intern at Microsoft | Previously: Visiting researcher at Princeton
2083l27 @2083l27.bsky.social 
Krzysztof Maziarz @maziarz.bsky.social Principal Researcher at Microsoft Research AI for Science, ML for Drug Discovery, ex Google AI & tensorflight
Marwin Segler @marwinsegler.bsky.social Machine Learning, {Org, Med, Comp} Chem, RL/Planning, AI-assisted Scientific Discovery & Creativity, Music. ELLIS Scholar. Team Lead at Microsoft Research AI for Science. 2xDad
Simon Olsson @smnlssn.bsky.social Associate Professor at Chalmers. AI for molecular simulation and inverse design. WASP Fellow. ELLIS Member. https://userpage.fu-berlin.de/solsson/
PrecisionLife @precisionlife.bsky.social Solving chronic disease with a new approach to precision medicine.
AVAILABLE NOW - The Post COVID DNA Wellness Report: https://precisionlife.com/postcovid
Emmanuel Noutahi @enoutahi.bsky.social ML 4 drug discovery @valenceai.bsky.social
John P. Overington @jpoverington.bsky.social Work at xymeai - Data Science, Cheminformatics, Computational Medicinal Chemistry, Structural Bioinformatics, Protein Engineering, SaaS, DaaS, AI/ML https://scholar.google.com/citations?user=52VMFeYAAAAJ
Jorge Bravo Abad @bravo-abad.bsky.social AI/ML for Science & DeepTech | PI of the AI for Materials Lab | Prof. of Physics at UAM. https://bravoabad.substack.com/
Kristina Ulicna @kristinaulicna.bsky.social AIxBio Research Scientist 👩🔬 | PhD Computational Biology 👩💻 | BSc Biomedicine 🧫 | "Singlecellologist" 🦠 into biologically meaningful representation learning 🧬 | Decoding life in London 🇬🇧
H. K. KHARTABIL @khartab.bsky.social 🇫🇷Theoretical & Computational Chemist ⚛️🧪🖥️🧬| #CompChem | #CompBio | #HPC | #ChemSky | #CompChemSky| #University | #Chemistry | #BioChemistry | #ESR | #URCA | #ComESR | #VeilleESR | #VeilleEN
Personal account💻📱
🧐Reposts are reflections, not endorsements🤔
Malte Franke @maltefranke.bsky.social Generative models for chemistry and materials science
Currently PhD student at ETH Zürich
Previously Dunia, MIT, EPFL, RWTH Aachen
Christof Jäger @cmjaeger.bsky.social Computational Chemist, drug developer, scientist, husband, dad of 3, Ex-Academic, Austrian, raised in Ger, lived in the UK, arrived in Sweden
Maarten Dobbelaere @maartendobbelaere.bsky.social Cheminformatics, AI in Chemistry
Postdoc @EPFL @FWOVlaanderen 🇧🇪 🇨🇭 • Connecting machine learning and chemical engineering for intelligent chemical processes
mrodobbe.github.io
Rebecca Neeser @rebeccaneeser.bsky.social PhD student @EPFL in Schwaller and Correia labs | previously @ETH Zurich and @MIT
Kjell Jorner @valencekjell.com Assistant Professor of Digital Chemistry at @ethzurich.bsky.social. Making chemistry more sustainable within NCCR Catalysis. Views my own.
https://dcl.ethz.ch
https://www.valencekjell.com
Radoslav Krivak @rdkbio.bsky.social 🧬 Structural Bioinformatics | 💊 AI/ML for Drug Discovery | Geometric DL
🔬 @iocbprague.bsky.social, prev. PhD @cusbg.bsky.social @mff.unikarlova.cuni.cz
Vicente Ordonez @vicenteor.bsky.social Rice University, Associate Professor of Computer Science. Computer Vision, Multimodal AI, Deep Learning. Houston, Texas. Check our work at https://vislang.ai/
Charles Vorbach @isoscalar.bsky.social Melting gpus for profit and AV.
Rohan Gorantla @rohangorantla.bsky.social Developing ML methods for Drug Discovery @ Novartis 🧬💻 | prev: PhD student @ University of Edinburgh with Toni Mey
FJ @farzanejp.bsky.social Postdoc @data science and AI division
#compchem/Molecular Dynamics/Protein Simulation #GROMACS #AI4science
#chemsky #compchemsky
Andreas Bender @andreasbender.bsky.social Cheminformatics, bioinformatics, drug discovery, computational life sciences etc - for more information please see https://andreasbender.de
Proud editor of the 'Cambridge Cheminformatics Newsletter' - please see https://www.drugdiscovery.net 
Kutand Alkım Bayer @kutandalkim.bsky.social IZTECH-Chemistry, I like to be Polymath(learning different subjects), Polygot(interested in the learning different languages) comments and opinions are my own RT≠ is not endorsement (he/him)
Alan Jeffares @alanjeffares.bsky.social Multiplying matrices @Cambridge_Uni & @MSFTResearch | PhD student in Machine Learning | Previously MSc @ucl & BSc @ucddublin
alanjeffares.com
Georg Bökman @bokmangeorg.bsky.social Geometric deep learning + Computer vision
Johan Edstedt @parskatt.bsky.social PhD student @ Linköping University
I like 3D vision and training neural networks.
Code: https://github.com/parskatt
Weights: https://github.com/Parskatt/storage/releases/tag/roma
Srijit Seal 🇺🇸🇬🇧🇩🇪🇯🇵🇮🇳 @srijitseal.com Senior Chemøinformatician at Merck | Postdoc@Broad Institute of MIT and Harvard, Cambridge(MA) | PhD@University of Cambridge(UK) | AI, Image Analysis, bioML, -omics data, and Cell Painting for drug discovery. srijitseal.com/tools
Luc Reym⌬nd @lreymond.bsky.social Organic chemistry passionate 🧪, mountain addict 🧗 & freediver 🤿. EPFL scientist and @spirochrome.com co-founder. 🇨🇭
Annalena Kofler @annalenakofler.bsky.social PhD Student at MPI-IS working on ML for Gravitational Waves | #MLforPhysics #SBI
https://www.annalenakofler.com
Pasquale Minervini @neuralnoise.com Researcher in ML/NLP at the University of Edinburgh (faculty at Informatics and EdinburghNLP), Co-Founder/CTO at www.miniml.ai, ELLIS (@ELLIS.eu) Scholar, Generative AI Lab (GAIL, https://gail.ed.ac.uk/) Fellow -- www.neuralnoise.com, he/they
Francesca Grisoni @fragrisoni.bsky.social Associate Prof | AI for drug discovery | Eindhoven University of Technology | Previously ETH Zurich & UniMiB | she/her 🏳️🌈
Per-Ola Norrby @peonor.bsky.social Chemist, husband, father, singer. Sustainability, catalysis, stereochemistry, predictive modeling. Senior Principal Scientist @astrazeneca.bsky.social Gothenburg. he/him
Almas @almas2.bsky.social PhD student at the University of Toronto
#bioinformatics #cancer #transcriptomics #spatialbiology #machinelearning
Ankur Parikh @ankur-parikh.bsky.social Staff Research Scientist at Google DeepMind. ML for Biology and Chemistry (Previously NLP). Former adjunct assistant prof at NYU.
All opinions my own.
https://scholar.google.com/citations?user=bRpjhycAAAAJ&hl=en&oi=ao
Pierpaolo Morgante (He/His) @piermorgante.bsky.social Content development editor @rsc.org focusing on North America. Theoretical chemist. LEGO fan. #DFT #compchem #chemistry #DogsofCompChem #Quantum
Proud member of #ChemSky
Personal+work account (all views my own)
📍Washington, DC metro area
Nathan Brown @nathanbroon.bsky.social Cheminformatics scientist living in #Aarhus #Denmark • Chair @UKQSAR • FRSA FRSB FRSC
https://scholar.google.com/citations?user=N0-4IgoAAAAJ
Kevin K. Yang 楊凱筌 @kevinkaichuang.bsky.social Principal Researcher in BioML at Microsoft Research. He/him/他. 🇹🇼 yangkky.github.io
Martin Vögele @martinvoegele.bsky.social Computational Biophysicist, Amateur Photographer, History+Language Nerd.
All views my own.
Website: https://martinvoegele.github.io/