Marta Skreta @martaowesyou.bsky.social UofT CompSci PhD Student in Alán Aspuru-Guzik's #matterlab and Vector Institute | prev. Apple
Anouar Benali @anouarb.bsky.social Computational Scientist focused on high accuracy electronic structure methods on HPC (QMC and sCI).
After more than a decade as a Science Lead at Argonne National Laboratory, I now Lead a Research Team at Qubit Pharmaceuticals.
Senja Barthel @senjabarthel.bsky.social Shapeologist: Topologist, Mathematical chemist. Recorder player. (she/her)
https://research.vu.nl/en/persons/senja-barthel
Tristan Bereau @tbereau.bsky.social Interested in biomolecular simulations and machine learning of soft matter and biomolecules. Prof at Heidelberg University
Hyunsoo @hspark1212.bsky.social Materials.AI | Research Associate at Imperial College London
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/
Christoph Schran @cschran.bsky.social Assistant Professor @ Cavendish Laboratory, University of Cambridge
Group leader of the FAST group: https://www.fast-group.phy.cam.ac.uk/ - J @jwatchorn.bsky.social @jwatchorn.bsky.social
@acscomp.bsky.social @acscomp.bsky.social 
Reymond Group @reymondgroup.bsky.social Research Group at DCBP UniBern
#Cheminformatics | #PeptideChemistry | #SmallMolecule | #DrugDiscovery | #OrganicSynthesis
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
Jason Yim @jyim.bsky.social PhD candidate at MIT CSAIL. Generative models, protein design.
Ex: DeepMind, Microsoft, Instagram, Johns Hopkins University.
Website: https://people.csail.mit.edu/jyim/
X: https://x.com/json_yim
Daniel Tabor @danieltabor.bsky.social Assistant Professor, Texas A&M Chemistry. Theoretical chemistry, focus currently on molecular and condensed phase spectroscopy, organic materials design, the Center for the Mechanical Control of Chemistry, and polymers. Views are my own. dtaborgroup.com
Andreas Mardt @andreasmardt.bsky.social ML for drug discovery, protein dynamics, medical image analysis, PhD, Max-Delbrück Center Berlin
RDKit: Open source cheminformatics @rdkit.bsky.social https://www.rdkit.org
https://github.com/rdkit/rdkit
@wellingmax.bsky.social @wellingmax.bsky.social 
ICLR Conference @iclr-conf.bsky.social International Conference on Learning Representations https://iclr.cc/
Lexin Chen @lexinc.bsky.social building tools to accelerate drug discovery.
🔗 https://lexin-chen.github.io/
Ryota Tomioka @ryotat.bsky.social Researcher at Microsoft Research AI for Science
https://scholar.google.co.uk/citations?user=TxdeO-UAAAAJ&hl=en
Lukas Heinrich @lukasheinrich.com High Energy Physics/Machine Learning/Data Science Prof @tum.de www.lukasheinrich.com
Hannes Stark @hannes-stark.bsky.social MIT PhD Student - ML for biomolecules - https://hannes-stark.com/
CECAM @cecamevents.bsky.social Promoting fundamental research on advanced computational methods
Kresten Lindorff-Larsen @lindorfflarsen.bsky.social Protein and coffee lover, father of two, professor of biophysics and sudo scientist at the Linderstrøm-Lang Centre for Protein Science, University of Copenhagen 🇩🇰
Dan Roy @roydanroy.bsky.social Research Director, Founding Faculty, Canada CIFAR AI Chair @VectorInst.
Full Prof @UofT - Statistics and Computer Sci. (x-appt) danroy.org
I study assumption-free prediction and decision making under uncertainty, with inference emerging from optimality.
Thomas Kipf @tkipf.bsky.social Research at Google DeepMind. Ex-Physicist. Controllable World Simulators (GNNs, Structured World Models, Neural Assets). TLM Veo Capabilities (Ingredients & more).
📍 San Francisco, CA
Zachary Lipton @zacharylipton.bsky.social Cofounder & CTO @ Abridge, Raj Reddy Associate Prof of ML @ CMU, occasional writer, relapsing 🎷, creator of d2l.ai & approximatelycorrect.com
Gianni De Fabritiis @gdefabritiis.bsky.social ON SABBATICAL. Computer Simulations, Computational Intelligence, AI.
Research professor and CEO https://www.acellera.com.
Scholar: https://scholar.google.com/citations?hl=en&user=-_kX4kMAAAAJ&view_op=list_works&sortby=pubdate
James Fraser @fraserlab.com Professor and Chair @UCSF/@UCSF_BTS - dynamic structural biology and open science - (he/him) - fraserlab.com- I Isaac Tamblyn @itamblyn.bsky.social Physicist pretending to know something about AI
Kirsten Lum @machsci.bsky.social 🌲🌲 Applied ML/AI, data science, MLOps | Wife of 1, mom of 2 | Co-Founder and CTO of http://storytellers.ai
python 🐍 AI 🤖 cloud ☁️ data 📊
I also talk about Jesus here: @itskirstenlum.bsky.social
Luisa Zintgraf @luisazintgraf.bsky.social RL & Meta-Learning @ DeepMind.
Sara Hooker @sarahooker.bsky.social I lead Cohere For AI. Formerly Research
Google Brain. ML Efficiency, LLMs,
@trustworthy_ml.
Megan Stanley @megstanley.bsky.social Microsoft Research AI for Science, previously physics @ Cambridge. views my own
Erwin Schrödinger Institute for Mathematics and Physics @esivienna.bsky.social The Erwin Schrödinger International Institute is a visitors-oriented research institute for mathematics and physics at the University of Vienna @univie.ac.at
www.esi.ac.at
Patrick Bryant @patrickbryant.bsky.social Appellate federal public defender. Alexandria, Va. Speaking only for myself; usual disclaimers apply.
adad8m @adad8m.bsky.social #chesspunk 🐙 #ML 🦈
Yu Xie @yuxie.bsky.social Research Scientist @Microsoft AI for Science. Ph.D @Harvard, B.S. @PKU
Mike Davidson @mikeindustries.com Head of Design for Microsoft AI. Designed some other products you have probably used like Twitter (sorry!) and ESPN.com. Showerhead connoisseur and conscientious shoelace objector.
Ivy Zhang @ivyzhang.bsky.social Computational chemist l PhD from John Chodera's group @ MSKCC
Gabriel Rocklin @grocklin.bsky.social Digests proteins. High-throughput protein biophysics and design, Northwestern University. www.rocklinlab.org
Prof. Stefan Rahmstorf @rahmstorf.bsky.social Climate scientist, professor of Physics of the Oceans in Potsdam. Dad. Opinions my own.
Born at 317 ppm CO2.
Martin Bauer @martinmbauer.bsky.social I'm a theoretical physicist at Durham University 
Gabriele Corso @gcorso.bsky.social PhD student @MIT • Research on Generative Models for Biophysics and Drug Discovery
amelie-iska @amelie-iska.bsky.social (She/her) I ❤️proteins! I’m an AI researcher and budding in silico molecular engineer focused mostly on proteins and small molecules. Intersex=awesome 😎🏳️🌈🏳️⚧️⚧️💻🎯🧬🧫🦠🔬⚗️🧪💊💉✡️🪬
Matt Hall @cispt2.bsky.social 🇦🇺 SD at NCATS, all about treatments for rare diseases, drug discovery and technologies. Views my own. Etc.
Luca Naef @lucanaef.bsky.social Co-Founder & CTO, @vant_ai
Forbes 30u30 but won't go to jail | prev. ETH Zurich Stanford McKinsey
AI x Bio/Chem. vi/vim
Eric Horvitz @erichorvitz.bsky.social Chief Scientific Officer of Microsoft.
Moon lover @moon1over.bsky.social This page contains moon pics.DM for credit removal. Some Photoshop image posted .
@ltalirz.bsky.social @ltalirz.bsky.social 
Randall Snurr @randallsnurr.bsky.social John G. Searle Professor of Chemical & Biological Engineering at Northwestern University
Manuel Ortuno @chemortuno.bsky.social Computational chemist working on catalysis #compchem
(homogeneous and #MOFs #COFs) at @ua.es
Brian Space @brianspace.bsky.social 🖥️🧪🍀dad&husband, friend, scientist, theoretical chemistry professor, actual poker player, strategist, humanist, Professor NC State Chem., AAAS Fellow http://drbrian.space 🪐🌌
Jay 🦋 @jay.bsky.team Founder & Chief Innovation Officer @ Bluesky
Working on @attie.ai
🌱 🪴 🌳
Ron Smaldone @ronsmaldone.bsky.social Professor of Chemistry at the University of Texas, Dallas. Porous Polymers | Covalent Organic Frameworks | 3D Printing | 🎸
Dr. Bernd M. Schmidt @bmschmidtlab.bsky.social We use supramolecular chemistry to access novel functional compounds and materials by self-assembly. We also love fluorine chemistry, photoswitches, and ultrasound and are located at Heinrich Heine University Düsseldorf, Germany.
Tegan Makal 🏳️⚧️ @makalmakal.bsky.social Assoc Prof @ UVA Wise. MOF chemistry, craft beer, post hardcore music (she/her)
David Ho @davidho.bsky.social Climate scientist; ocean carbon cycle and climate solutions. Professor @soest.hawaii.edu, University of Hawaiʻi at Mānoa; Visiting Faculty, Arizona State University. https://linktr.ee/david_ho
Sarah Burch @sarahlynnburch.bsky.social Professor, Canada Research Chair - Sustainability transitions and climate change policy. University of Waterloo, 🇨🇦
Executive Director, Waterloo Climate Institute. IPCC LA 6AR, WGIII.
Alireza Raissadati @aliraissadati.bsky.social physician-scientist
advanced fellow | pediatric heart failure and transplantation
postdoctoral fellow | transplant immunology
Lucile Packard Children’s Hospital | Cardiovascular Institute | Stanford
Alfonso T. García-Sosa, PhD @garciasosa.bsky.social 🇲🇽Assoc. Prof. @UniTartu | Fmr. Postdoc @MayoClinic | PhD @Cambridge_Uni | BSc @Quimica_UNAM | Senior Lead, Data Science @Proekspert
Machine Learning, AI, Molecular Design, Biomolecular modeling,
https://hermes.chem.ut.ee/~alfx 
Alexander Bonnet @alexanderbonnet.bsky.social research @ chai discovery
David Ryan Koes @dkoes.compstruct.org Removing barriers to computational drug discovery one bit at a time. Associate Professor in Computational and Systems Biology at the University of Pittsburgh.
https://bits.csb.pitt.edu/
Derya Unutmaz M.D. @biohacker.bsky.social Professor, biomedical scientist, human immunologist at https://www.jax.org/ doing research on T cell immunology, immune aging & cancer immunotherapy. Interests #longevity #robotics #AI #Scifi #space #aiart
Greg Bedwell @gbedwell.bsky.social Protein chemist, computational biologist, and general data enthusiast. Big fan of good food, sports, travel, and books.
Jack Smith @jacks1016.bsky.social Semi-retired computational quantum chemist and material scientist with an extensive (50+ years) background in research computing and a new passion for developing AI/ML applications.
Daniel van Strien @danielvanstrien.bsky.social Machine Learning Librarian at @hf.co
Philipp Benner @pbenner.bsky.social {ML,Statistics}@{Materials,Bioinformatics}
https://bamescience.github.io
Leonardo Medrano @lmedranos88.bsky.social Computational physicist/chemist at Dresden University of Technology, Germany | Chemical Physics, Machine learning, NanoPhononics, Computational modeling, Materials Science 🇵🇪
Protera @proterabio.bsky.social Smarter proteins for a sustainable future.
#ProteinEngineering #ArtificialIntelligence #Biotechnology
Tedy @cheilion.bsky.social Even AI needs a dentist
CEO & Co-founder of Autodontics - the first dental AI think tank
https://www.linkedin.com/in/cheilion/
Ciaran Malone @ciaranmalone.bsky.social Medical Physicist/Research Fellow @SLRON, Dublin, Ireland. Radiotherapy, AI, Data science. Views are my own.
Steven Yu @stevenyuyy.bsky.social BME & CS @Columbia | AI x Bio Researcher @ColumbiaMed | Kaggle Competitions Master
https://stevenyuyy.us
Neil Kazimierz Sheridan @koalaswelcomehere.bsky.social /protect our world/ neurosci, CS, अहिंसा , mmorpgs, maker I ❤️ elephants🐘 & octopuses🐙 ! he/him // 🌱// solarpunk //book🐛 #anticapitalism [@koalaswelcomehere@chaos.social]
pixelfed.social/koalaswelcome
Rui Carvalho @rui--carvalho.bsky.social Assistant Professor at Durham University.
AI4Science
https://www.ruicarvalho.org/
Robert Iafe @robertiafe.bsky.social =⋙÷ organic chemist ⌬, assoc prof & chair csusm, ucla/lmu alum, #chemistry enthusiast, 🐕 daddy, my own views, 🌈 ally, he/him/his
Pat Walters @wpwalters.bsky.social Cheminformatics, ML, Drug Discovery
Michelle Ernst @michelle-ernst.bsky.social Postdoc at the University of Bern.
Computational Chemist & Crystallographer. Simulating molecules, reactions, and materials.
@sikaeser.bsky.social @sikaeser.bsky.social Computational Chemistry | Machine Learning | Molecular Modelling
Postdoctoral Fellow at Roche, pRED
David Rosenberger @drosen285.bsky.social Computational physical chemist. Currently Postdoc@BAM (Bundesanstalt für Materialforschung-und prüfung). Real Football and American Football Enthusiast
Rachel Gregor @rachelgregor.bsky.social Assistant Professor at the University of Toronto in Chemical Engineering and Applied Chemistry. Fascinated by microbial communities and their chemistry. https://www.gregorlab.com/
Fiona McMillan @moraigmonkey.bsky.social Personal account but share lots of fantastic work of RSC member networks - views all my own.
Lover of my kids, chemistry, Lego, Scotland and amazing but tiny museums.
Also vocal about autism, dyslexia, dysgraphia, Star Trek and crochet.
Johannes Kästner @johanneskaestner.bsky.social Computational chemistry professor at @unistuttgart.bsky.social simulating reaction mechanisms, atom tunneling, astrochemistry, MachineLearning.
https://www.uni-stuttgart.de/theochem/kaestner
BusyBrain⌨ @w42.bsky.social Interested in how machine can speak human language and automated theorem proving
Chen-Yang Su, PhD @chenyangsu.bsky.social Postdoctoral Fellow
PhD @mcgill.ca
https://chenyangsu.github.io/
Previously MSc @mila-quebec.bsky.social
Twitter: https://x.com/chenyangsu
Derrick Cogburn @derrickcogburn.bsky.social Scholar. Teacher. Sailor: Full Professor @AmericanU @KogodBiz & @ausis | Director idppglobal.org and internetgovernancelab.org | Data scientist doing #TextAnalysis #NLP using #AI #ML #LLMs #Python #RStats #Positron #HPC #a11y #CSCW #HCI
Seong Joon Oh @coallaoh.bsky.social Professor in Scalable Trustworthy AI @ University of Tübingen | Advisor at Parameter Lab & ResearchTrend.AI
https://seongjoonoh.com | https://scalabletrustworthyai.github.io/ | https://researchtrend.ai/
Adam Lång @adaml92.bsky.social Machine learning engineer and researcher. Previously PhD in computational biology in Neuro-oncology at Uppsala University
Arij Riabi @arijriabi.bsky.social PhD student working on NLP for low-resource, non-standardized language varieties 🍉
Till Richter @richtertill.bsky.social Machine Learning for Computational Biology | PhD Student @ TUM, Helmholtz Munich with Fabian Theis, Niki Kilbertus
Thiago Serra @thserra.bsky.social Assistant professor at University of Iowa, formerly at Bucknell University, mathematical optimizer with an #orms PhD from Carnegie Mellon University, curious about scaling up constraint learning, proud father of two
Willi @willigo09.bsky.social Working on #SelfDrivingLabs at the Acceleration Consortium @ UofT. Former employee at dsm-firmenich working on self-driving labs for food applications. Interested in systems biology, microbial communities, ML/AI, software development, product management.
Guobin Zhao @guobinzhao.bsky.social Postdoctoral fellow at National University of Singapore.
Work on Molecular Simulation, Machine Learning, and Big Data.
https://t.co/8zwRaqM9d5
Weilai Yu @yuweilai93.bsky.social at the University of Toronto (ChemE)
http://logics-utoronto.org
Matthew Evans @ml-evs.science Postdoc (UCLouvain & Matgenix) interested in materials discovery and data management for open science, trying my own stuff at https://datalab.industries | https://github.com/ml-evs | https://ml-evs.science
FJ @farzanejp.bsky.social Postdoc @data science and AI division
#compchem/Molecular Dynamics/Protein Simulation #GROMACS #AI4science
#chemsky #compchemsky
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