Dan Margolies @danmargolies.bsky.social Historian thinking about música del coronavirus, conjunto, bees, huapangos, cultural sustainability & submerged land.
https://danmargolies.com/
amro @amro.dev
Recovering iOS dev, EM, ex-Twitter
Sung Kim @sungkim.bsky.social A business analyst at heart who enjoys delving into AI, ML, data engineering, data science, data analytics, and modeling. My views are my own.
You can also find me at threads: @sung.kim.mw
Karen McGrane @karenmcgrane.bsky.social On a good day, I make the web more awesome. On a bad day, I just make it suck less. 
Jeff Dean @jeffdean.bsky.social Google Chief Scientist, Gemini Lead. Opinions stated here are my own, not those of Google. Gemini, TensorFlow, MapReduce, Bigtable, Spanner, ML things, ...
Zeming Lin @ebetica.bsky.social Bio/ML. Co-founder at EvoScale, worked on Pytorch and StarCraft back at meta. Most likely not skynet.
James Kirk @jiminykirket.bsky.social ML/AI @ Electric Plant Co, prev ML/RecSys at Spotify. A nervous little punk boy.
Mounia Lalmas @mounialalmas.bsky.social Research @ Spotify
https://mounia-lalmas.blog/mounia-lalmas/
hardmaru @hardmaru.bsky.social Co-Founder & CEO, Sakana AI 🎏 → @sakanaai.bsky.social
Visit → https://sakana.ai/
Claas Voelcker @cvoelcker.bsky.social For professional, see https://cvoelcker.de
If I seem very angry, check if I have been watered in the last 24 hours.
Now 🇺🇸 flavoured, previously available in 🇨🇦 and 🇩🇪
@awiltsch.bsky.social @awiltsch.bsky.social 
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
Anne Carpenter @drannecarpenter.bsky.social Dedicated to drug discovery, enthralled by science. 5 kids. She. SAB Recursion. Founder SyzOnc. Lab at Broad Institute. Opinions my own.
Derek Lowe @dereklowe.bsky.social Medicinal chemist / chemical biologist, author of “In the Pipeline” at http://science.org/blogs/pipeline. derekb.lowe@gmail.com and on Signal at Dblowe.18
All opinions are mine; I don’t speak for my employer in any way.
RDKit: Open source cheminformatics @rdkit.bsky.social https://www.rdkit.org
https://github.com/rdkit/rdkit
Shantanu Singh @shantanu-singh.cc computation biology, drug discovery, computer vision, microscopy, statistics, machine learning, all happening at https://carpenter-singh-lab.broadinstitute.org/
Jess Ewald @ewaldlab.org Computational biologist using omics data (imaging, gene expression) to investigate the impacts of environmental contaminants on biological systems
Group Leader @EMBL-EBI (www.ewaldlab.org)
Karen Weber @kacweber.bsky.social 
@koji-oda.bsky.social @koji-oda.bsky.social Computational Drug Discovery and Design, SBDD, LBDD, ML
Evi Gkeka @evigkeka.bsky.social Molecular modeler @Sanofi, #AppliedMathematics, #MolecularSimulations and #DrugDesign. Tango dancer and world traveler.
Miles Gander @milesgander.bsky.social Head of Large Libraries @ http://Cradle.Bio - Engineering better proteins, faster. SynBio+AI/ML - Synthetic biologist and Seattle sports fan.
https://www.linkedin.com/in/mileswgander
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
Mark Basham @markbasham.bsky.social Science Director for AI at #RosalindFranklinInstitute creator of the #LegoBeamline and #DiamondTheGame. #SoftwareSustainabilityInstitute and #InstituteOfPhysics Fellow. #Dad he/him
John Gardner @jla-gardner.bsky.social ML for Potential Energy Surfaces
PhD student at Oxford
Former Microsoft AI4Science Intern
Acellera @acellera.com AI-Driven Drug Engineering: Building a discovery factory.
www.acellera.com
Quico Sabanés @qsabanes.bsky.social In a love-hate relationship with free energy calculations. In a love-love relationship with cats
CompChem @acellera.com
Pavan Behara @pavanbehara.bsky.social Computational chemist, doing CADD @ UCI's Center for Neurotherapeutics. Former chemical engineer turned drug hunter. Buffalonian at heart! Go Bills!!! 🏈
💊🧠💻🧬🧪
#తెలుగోడు
Disclaimer: Views expressed are my own, not those of my employer or affiliates.
Serge Parel @spparel.bsky.social Cheminformatics • Research IT • Data Science - All opinions are strictly my own ! 
Patrick A. Robertson @ghettsmart.bsky.social Assistant Professor of Physical Chemistry. I blow up molecules with lasers in the vain hope that I might one day learn about their structure before they blew up. Washed-up MTG dream chaser. He/Him
www.nurd.org.uk
Pablo Arantes @pabloarantes.bsky.social #compchem Research Scientist at Vita Nova Institute- Work interests mostly related to the simulation of biomolecular systems - Lead developer of the Making It Rain, Cloud-Bind and ParametrizANI projects.
https://pablo-arantes.github.io/
Thomas Coudrat @tomsilico.bsky.social Computational chemistry and AI for drug design in biotech #compchem | CSIRO, Melbourne AU
Rafael Lameiro @rflameiro.bsky.social 🇧🇷 Using Python and Machine Learning in Chemoinformatics research for Medicinal/Biological Chemistry. Fascinated by plants and the human brain.
Asma Feriel Khoualdi @asmaferiel.bsky.social PhD @ColeGroupNCL.bsky.social Drug Design EPSRC-MoSMed CDT + collab @openSciSaudi + Artist alum: @mcgillu @UMontreal 🇯🇴 🇩🇿 🇸🇦 🇨🇦 🇬🇧 website 👉 asmaferiel000.github.io/AsmaFeriel.git…
Maryam Kosar @maryamk.bsky.social PhD, Computational Chemistry | Cheminformatics | CADD | She/Her | 🇨🇦
LinkedIn: https://ca.linkedin.com/in/maryam-kosar-b490368b
Gautam @gautammalik.bsky.social Research Assistant at University of Cambridge | Exploring deep learning in biology with big dreams of using AI to make drug discovery a little less complicated!🧬🖥️
Imran S. Haque @ihaque.bsky.social CTO at Kimia Therapeutics. Formerly SVP AI at Recursion.
https://ihaque.org
https://x.com/ImranSHaque
@macinchem.bsky.social @macinchem.bsky.social 
Martin Elstner @martin.elstner.dev AI and ML engineering. Search and recommendation. Founder of Elstner Analytics. Helping companies solve their data issues
https://elstner.dev
Jenny Lin @jhylin.bsky.social Enthusiast in using Python for drug data. Occasionally uses R. Used to be a pharmacist and happened to have a comp/med chem PhD.
Janus Juul Eriksen @januseriksen.bsky.social Assoc. prof. in #compchem at DTU (🇩🇰) -- Previously: Bristol Uni (🇬🇧) & Uni Mainz (🇩🇪). Member of @theyoungacademydk.bsky.social (🇩🇰, 2022-27).
Razvan Borza @rborza.bsky.social PhD Candidate at Netherlands Cancer Institute〡Structural Biology〡Experimental–Computational Integration〡
Curious about AI-Integrated Biology and Synthetic Biology 🔬〡
Bioillustration using Blender🧬〡
https://beacons.ai/rborza
Daniel Álvarez Salmoral @alvarezsalmoral.bsky.social PhD Candidate at @NKI_nl in Structural Bioinformatics - Cancer Research | Perrakis lab |
Interest in AI | Computational Biology, Statistics, Protein Prediction & Design 🖥️🧬
AlphaBridge web server: https://alpha-bridge.eu/
Paulo Martel @curvedglass.bsky.social Science, music, photography, computers, VR and more...
Interested in biomolecular simulation, modelling, protein structure, drug design and AI.
Dr Javier Sánchez Utgés @javierutges.bsky.social Postdoctoral Research Assistant in the @cathgene3d.bsky.social Group at @ucl.ac.uk
LIGYSIS-web: tinyurl.com/Utges-LIGYSIS
Ligand site prediction benchmark: tinyurl.com/Utges-LBS
Fragment screening sites: tinyurl.com/Utges-FRAGSYS
Layla @laylagerami.bsky.social 
Ho Leung Ng @ai-drugs.bsky.social AI/computational drug discovery. Consultant/scientific advisor. Former professor. Berkeley.
Nil Adell Mill @niladm.bsky.social Co-Founder @ Decycle Bio
Engineering biology to catalyze the unnatural
Pat Walters @wpwalters.bsky.social Cheminformatics, ML, Drug Discovery
Arushi @arushigkmajha.bsky.social Scientist 💭💻🧠 AI/ML+MedChem PhD @ University of Cambridge • Director @ Women in Machine Learning • she/godless/non-mum 🧚♀️ • dc/dvij/brit 💩• sentient welfare, near+longterm 🖤
Cas @caswognum.nl Trying to teach machines (and myself) drug discovery at Valence Labs and Polaris.
www.caswognum.nl
🇳🇱🇨🇦
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 
Morgan Thomas @morganthomas.bsky.social Cheminformatics | Machine learning | Generative AI
Postdoc Computational Sciences, UPF, Barcelona
Jackson Burns @fastprop.bsky.social Researcher- R Bharath Ramsundar @rbhar90.bsky.social Founder and CEO of Deep Forest Sciences. Lead Developer of DeepChem. AI for Science Researcher.
Manas Mahale @manasmahale.bsky.social Cheminformatics | manasmahale.in
Anika Liu @anikaliu.bsky.social CompBio/Data Science in Drug Discovery 🤓
• CompBio @Boehringer Ingelheim
• Cambridge PhD & Heidelberg BSc/MSc
• Also: 🪴🗺🚲🍜
Benoit Baillif @bbaillif.bsky.social Computational chemistry and machine learning
Yazan J. Meqbil @yazmeq.bsky.social Molecular Pharmacologist automating the intersections of HTS, computational modeling, and molecular pharmacology | Pasadena, CA
Alvascience @alvascience.bsky.social Software Solutions for Cheminformatics and QSAR
https://www.alvascience.com/
#QSAR #cheminformatics #machinelearning #moleculardescriptors #compchem
CCDC Cambridge @ccdc.cam.ac.uk The CCDC is a non-profit, charitable institution focused on the advancement & promotion of chemistry & crystallography.
Website: https://www.ccdc.cam.ac.uk/
Daniel Ukaegbu @darniee.bsky.social PhD student in computational toxicology @johnshopkins.bsky.social
Lukas Friedrich @lukfri.bsky.social Applying AI in drug discovery.
Working at Merck Healthcare KGaA (Germany)
Lexin Chen @lexinc.bsky.social building tools to accelerate drug discovery.
🔗 https://lexin-chen.github.io/
Christopher Southan @cdsouthan.bsky.social Joining the dots between chemistry and biology (full profile on LinkedIN) 
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
Adit Shah @aditshah.bsky.social ML for Science 💻🧬| Research Engineer @ Cradle Health | EECS @ UC Berkeley | Prev ML research at Broad Institute, Berkeley AI | Thinking & writing about urbanism
Rohan Gorantla @rohangorantla.bsky.social Developing ML methods for Drug Discovery @ Novartis 🧬💻 | prev: PhD student @ University of Edinburgh with Toni Mey
Barry Bentley, PhD, FRSB @bbentley.bsky.social Reader (Assoc. Prof.) in Bioengineering at Cardiff Met | Fulbright Scholar at Harvard Med | Head, Bio-AI Lab eureka robot | Formerly MRC LMB, Cambridge Uni
Yu Zhang @yu-zh.bsky.social Postdoctoral Fellow, Collins Lab @ Broad Institute and Wyss Institute at Harvard and MIT | AI in drug discovery
Polaris @polarishub.io ML-ready datasets and benchmarks for drug discovery.
https://polarishub.io
RSC-CICAG @rsc-cicag.bsky.social RSC-CICAG (Royal Society of Chemistry Chemical Information & Computer Applications Group) is one of the RSC’s member-led Interest Groups. If you have questions talk to us on LinkedIn: https://www.linkedin.com/company/rsc-cicag/
https://www.rsccicag.org/
Ernest A-Williams @ernestchemist.bsky.social Scientist in Drug Discovery | Drug hunter | Previously: Postdoc @Novartis | Reimagining drug discovery with computers #CASFutureLeaders ‘22
Kevin Greenman @kevinpgreenman.bsky.social 🤖 AI for Science 🌟☧ Asst Prof. @CathInstTech |
🎓 Ph.D. @mitcheme.bsky.social ’24 (@rgblabmit.bsky.social) |
💊💻 Ex: @msftresearch.bsky.social & @elilillyandcompany.bsky.social & Chemprop maintainer |
www.kevinpgreenman.com
Casey Newton @caseynewton.bsky.social Email salesman at Platformer.news and co-host at Hard Fork.
Ian Goodfellow @ian-goodfellow.bsky.social Research Scientist at DeepMind. Opinions my own. Inventor of GANs. Lead author of http://www.deeplearningbook.org . Founding chairman of www.publichealthactionnetwork.org
Oscar Boykin @posco.dev Some guy on Maui
Neuroskeptic @neuroskeptic.bsky.social 
Julia Evans @b0rk.jvns.ca programming and exclamation marks
blog: jvns.ca
zines: wizardzines.com
Ben Sandofsky @sandofsky.com I make Halide and Kino.
Gintare Karolina Dziugaite @gkdziugaite.bsky.social Sr Research Scientist at Google DeepMind, Toronto. Member, Mila. Adjunct, McGill CS. PhD Machine Learning & MASt Applied Math (Cambridge), BSc Math (Warwick). gkdz.org 
Richard McElreath 🐈⬛ @rmcelreath.bsky.social Anthropologist - Bayesian modeling - science reform - cat and cooking content too - Director @ MPI for evolutionary anthropology https://www.eva.mpg.de/ecology/staff/richard-mcelreath/
Paul Bürkner @paulbuerkner.com Full Professor of Computational Statistics at TU Dortmund University
Scientist | Statistician | Bayesian | Author of brms | Member of the Stan and BayesFlow development teams
Website: https://paulbuerkner.com
Opinions are my own
Michael "Shapes Dude" Betancourt @betanalpha.bsky.social Zealous modeler. Annoying statistician. Reluctant geometer. Support my writing at http://patreon.com/betanalpha. He/him.
Shakir Mohamed @shakirm.bsky.social AI, sociotechnical systems, social purpose. Research director at Google DeepMind. Cofounder and Chair at Deep Learning Indaba. FAccT2025 co-program chair. shakirm.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
Alex Lew @alexlew.bsky.social Theory & practice of probabilistic programming. Current: MIT Probabilistic Computing Project; Fall '25: Incoming Asst. Prof. at Yale CS
Yarin @yaringal.bsky.social Associate Professor of Machine Learning, University of Oxford;
OATML Group Leader;
Director of Research at the UK government's AI Safety Institute (formerly UK Taskforce on Frontier AI)
Jakob Macke @jakhmack.bsky.social #AI4Science #CompNeuro #NeuroAI #SBI
www.mackelab.org @mackelab.bsky.social
· PI and Hector Fellow ELLIS Institute @ellisinsttue.bsky.social tue.ellis.eu
· Prof Uni Tuebingen @ml4science.bsky.social BCCN tue.ai
Marvin Schmitt @marvin-schmitt.com ⛵️ Research Scientist @ Midjourney
🇪🇺 Member @ellis.eu
🤖 Generative NNs, Deep Learning, ProbML, Simulation Intelligence
🎓 PhD+MSc Computer Science, MSc Psychology
🏡 https://marvin-schmitt.com
Lena Zellinger @lenazellinger.bsky.social ELLIS PhD student at the University of Edinburgh working on guarantees for approximate inference
@rogergrosse.bsky.social @rogergrosse.bsky.social 
Alex Alemi @alexalemi.bsky.social Machine Learning Researcher
https://alexalemi.com
https://blog.alexalemi.com
Luigi Acerbi @lacerbi.bsky.social Assoc. Prof. of Machine & Human Intelligence | Univ. Helsinki - Finnish Centre for AI - ELLIS Institute Finland | Bayesian ML & probabilistic modeling | https://lacerbi.github.io/
Aaron Schein @aaronschein.bsky.social Assistant Professor of Statistics & Data Science at UChicago
Topics: data-intensive social science, Bayesian statistics, causal inference, probabilistic ML
Proud “golden retriever” 🦮
Martin Trapp @trappmartin.eurosky.social Assistant Prof in Prob ML @ KTH 🇸🇪
WASP Fellow & ELLIS Member
Ex: Aalto Uni 🇫🇮, TU Graz 🇦🇹, originally 🇩🇪.
—
https://trappmartin.github.io/
—
Reliable ML | UQ | Bayesian DL | tractability & PCs
Sebastian Farquhar @sebfar.bsky.social Senior Research Scientist at Google DeepMind. AGI Alignment researcher. Views my dog's.
Tycho van der Ouderaa @tychovdo.bsky.social Postgraduate researcher (PhD) at Imperial College London and visiting researcher at the University of Oxford. Working on probabilistic machine learning.
@wellingmax.bsky.social @wellingmax.bsky.social