Stephanie Wankowicz @stephanieaw.bsky.social Computational Structural Biologist
Scientific Program Director, Prism
Adjunct Professor, Vanderbilt University
(she/her)
prismscience.org
Past: Vanderbilt, UCSF, Dana-Farber, Broad Institute, UMass Amherst
Covalent Modifiers @covalentmod.bsky.social A BlueSky feed for the blog http://covalentmodifiers.blogspot.com. Discusses the covalent modification of proteins, particularly with regards to inhibitors.
Phillip Isola @phillipisola.bsky.social Associate Professor in EECS at MIT. Neural nets, generative models, representation learning, computer vision, robotics, cog sci, AI.
https://web.mit.edu/phillipi/
Peter Škrinjar @peterskrinjar.bsky.social PhD student at @biozentrum.unibas.ch.
OpenBind @openbind.bsky.social OpenBind is building the world’s largest open-access dataset of drug–protein interactions to speed up new treatments. Through cutting-edge science and open collaboration, we power AI tools for structure-based drug design – free for all.
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.
Nikolai Slavov @slavov-n.bsky.social Mentor, scientist & engineer. Having fun in @slavovlab.bsky.social and Parallel Squared Technology Institute @parallelsq.bsky.social with biology & single-cell proteomics.
https://nikolai.slavovlab.net
Chence Shi @chenceshi.bsky.social CS PhD Mila
Tian Xie @xie-tian.bsky.social Principal Research Manager & Project lead @ Microsoft Research AI for Science; AI for materials; Previously @ MIT, DeepMind, Google X. Views my own.
NeurIPS Europe @neuripseurope.bsky.social NeurIPS Europe is an official satellite event of NeurIPS @neuripsconf.bsky.social that will be held in Paris from December 9th to 13th.
To sponsor us: sponsoring@neurips-europe.cc
Rob Horne @robertihorne.bsky.social Drug discovery fellow @ D. E. Shaw Research focusing on cancer treatments 🧫 PhD from Uni of Cambridge working on inhibitors of neurodegenerative disease 🧠
Dr. Fei-Fei Li @drfeifei.bsky.social Prof (CS @Stanford), Co-Director @StanfordHAI, Cofounder/CEO @theworldlabs, CoFounder @ai4allorg #AI #computervision #robotics #AI-healthcare
Samuel Stanton @activelearner.bsky.social Principal Machine Learning Scientist @PrescientDesign @Genentech @Roche | @NYUDataScience PhD | developing AI agents for scientific discovery in biotech
Sergey Ovchinnikov @sokrypton.org Scientist, Assistant Professor at MIT biology, #FirstGen
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.
David Nordström @davnords.bsky.social Phd Student @ Chalmers
Deep Learning for Computer Vision.
Strengthen your ViTs: https://github.com/davnords/octic-vits
Alexandros @alexandrosangeli.bsky.social 🍉 🕊️
Informatics PhD @ University of Edinburgh
CeMM @cemm.oeaw.ac.at International, independent, interdisciplinary research institute. Integrates basic research and clinical expertise for innovative diagnostics and therapeutics.
🔗 http://www.cemm.oeaw.ac.at/
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/
pen(Taka) @iwatobipen.bsky.social Medicinal Chemist, Cheminformatician, Runner and ?
Cecilia Clementi @cecclementi.bsky.social Scientist & Scuba Diver - I love theoretical physics, sharks, and pygmy seahorses - http://www.instagram.com/clementicecilia - http://www.physik.fu-berlin.de/en/einrichtungen/ag/ag-clementi
Harry Moore @jhmchem.bsky.social PhD candidate @ Cambridge Engineering | Founding engineer @ Angstrom AI | ML & molecular simulation 
Michele Ceriotti @micheleceriotti.bsky.social Italian in Switzerland, @lab_COSMO PI. Husband of one, father of three. Increasing the entropy of the universe since 1982.
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
John Chodera @jchodera.bsky.social Achira | http://achira.ai
Research laboratory | http://choderalab.org
Antiviral drug discovery for pandemics | http://asapdiscovery.org
OpenADMET | http://openadmet.org
Employer-mandated disclaimer: http://choderalab.org/disclaimer
Pronouns: he/him
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- T Thomas Dietterich @tdietterich.bsky.social Safe and robust AI/ML, computational sustainability. Former President AAAI and IMLS. Distinguished Professor Emeritus, Oregon State University. https://web.engr.oregonstate.edu/~tgd/
Alexandre Duval @NeurIPS @aduvalinho.bsky.social Co-founder & CSO @Entalpic | AI for materials discovery | PhD in Graph ML, ex-Mila, ex-Amazon | #AIforClimateChange, #AI4Science
Andrea Dittadi @andreadittadi.bsky.social postdoc at Helmholtz AI & TUM | diffusion/flows & (causal) representation learning | previously DTU Copenhagen, MPI Tübingen, Microsoft Research, Amazon
addtt.github.io
Marco Cuturi @marcocuturi.bsky.social machine learning researcher @ Apple machine learning research 
Shubhendu Trivedi @shubhendu.bsky.social https://shubhendu-trivedi.org
Andrew Campbell @arcampbell.bsky.social Research Scientist, Google DeepMind. Previous: Xaira Therapeutics, PhD OxCSML Oxford University.
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
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/
Emma Flynn @emmaflynn.bsky.social PhD student at CMU-Pitt Comp Bio. Generative models for small molecule drug design
Torsten Schwede @torstenschwede.bsky.social Computational Structural Biology @biozentrum.unibas.ch @unibas.ch @sib.swiss | President of the Research Council of the @snsf-ch.bsky.social | Team Science 🧪
Ahmet Sarigun @asarigun.bsky.social curious explorer - https://asarigun.github.io/
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! 🦠
AI x Bio Discovery @aixbiobot.bsky.social Automated discovery of AI x Bio papers, blogs, and news.
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.
@chrisdkolloff.bsky.social @chrisdkolloff.bsky.social 
Pascal Notin @pascalnotin.bsky.social Research in AI for Protein Design @Harvard | Prev. CS PhD @UniofOxford, Maths & Physics @Polytechnique
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
Journal of the American Chemical Society (JACS) @jacs.acspublications.org Research, news, and information from the Journal of the American Chemical Society: pubs.acs.org/JACS
Fredrik K. Gustafsson @fregu856.bsky.social Postdoc at AstraZeneca in Cambridge. Machine learning in medicine.
https://www.fregu856.com/
AITHYRA Research Institute of the Austrian Academy of Sciences @aithyra.bsky.social AITHYRA is a new dynamic research institute for biomedical AI in Vienna. AITHYRA seeks to build Europe’s premier institute for AI-driven biological and medical research, uniting computer scientists, engineers, and biologists in a collaborative environment.
@gembioworkshop.bsky.social @gembioworkshop.bsky.social 
Ilia Igashov @igashov.bsky.social PhD student at LPDI, EPFL 🇨🇭
AI & Structural Biology
@kyunghyuncho.bsky.social @kyunghyuncho.bsky.social a mediocre combination of a mediocre AI scientist, a mediocre physicist, a mediocre chemist, a mediocre manager and a mediocre professor.
see more at https://kyunghyuncho.me/
WeRateDogs @weratedogs.com Your Only Source For Professional Dog Ratings
nonprofit: @15outof10.org ❤️🩹
links.weratedogs.com
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
Martin Pacesa @martinpacesa.bsky.social Assistant Professor at the University of Zurich.
🖥️ protein design, machine learning🤖, crystallography💎, cryoEM🔬. Anti-theist. Avid weirdness connoisseur 🎩 http://www.pacesalab.com/
Roberto Covino @rocovino.bsky.social Professor of Computational Life Science at Goethe University Frankfurt. Computer simulations of biomolecular systems, statistical modeling, and machine learning.
Elise van der Pol @elisevanderpol.bsky.social Working on machine learning for science and symmetry/equivariance in RL. She/her. Senior Researcher at Microsoft Research Amsterdam. https://www.elisevanderpol.nl/ & https://sigmoid.social/@elisevanderpol
Timothy P. Jenkins @tpjenkins.bsky.social I am an Associate Professor at DTU and leading the Digital Biotechnology Lab. I am passionate about harnessing the power of modern technology such as AI Protein Design to innovate the biotechnological landscape and develop real world solutions.
Wouter Boomsma @wouterboomsma.bsky.social Using machines to learn about biology.
@briantrippe.bsky.social @briantrippe.bsky.social Assistant Professor at Stanford Statistics and Stanford Data Science | Previously postdoc at UW Institute for Protein Design and Columbia. PhD from MIT.
Lee Cronin @leecronin.bsky.social Regius Professor. Scientist, Chemist, Inventor, CEO of Chemify. Fascinated & in a state of confusion & optimism. Trying to digitize chemistry & make alien life.
Michael Albergo @msalbergo.bsky.social junior fellow at @Harvard.edu, incoming prof at @HSEAS and @Kempnerinstitute.bsky.social studying machine learning and its applications to nature and the sciences
Günter Klambauer @gklambauer.bsky.social Deep Learning researcher | professor for Artificial Intelligence in Life Sciences | inventor of self-normalizing neural networks | ELLIS program Director
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
Matteo Degiacomi @matteodegiacomi.bsky.social Reader at the University of Edinburgh, using molecular dynamics and machine learning to study protein structure and assembly.
Karsten Kreis @karstenkreis.bsky.social Principal Research Scientist at NVIDIA | Former Physicist | Deep Generative Learning | https://karstenkreis.github.io/
Opinions are my own.
Jablonka Lab (Lab for AI for Materials) @jablonkagroup.bsky.social Team-run account for the group led by @kjablonka.com
Theofanis Karaletsos @tkaraletsos.bsky.social Head of AI @cziscience | Achira.ai | probabilistic and deep ML
Janosch Menke @janoschm.bsky.social ML and Cheminformatics Research Engineer at deepmirror
Alex Zhavoronkov @elonverse.bsky.social My only objective function is to extend productive longevity for everyone on the planet. Here to share research papers. https://x.com/biogerontology
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
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
Emmanuel Bengio @bengioe.bsky.social ML @ LawZero
https://folinoid.com
Reymond Group @reymondgroup.bsky.social Research Group at DCBP UniBern
#Cheminformatics | #PeptideChemistry | #SmallMolecule | #DrugDiscovery | #OrganicSynthesis
Austin Tripp @austinjtripp.bsky.social (ML ∪ Bayesian optimization ∪ active learning) ∩ (drug discovery)
Researcher @valenceai.bsky.social
Details: austintripp.ca
Eric Topol @erictopol.bsky.social physician-scientist, author, editor
https://www.scripps.edu/faculty/topol/
Ground Truths https://erictopol.substack.com
SUPER AGERS https://www.simonandschuster.com/books/Super-Agers/Eric-Topol/9781668067666
Gräter lab @graeterlab.bsky.social We aim at unraveling the intricacies of molecular perception and designing sensing molecular systems from the ground up. We work at the interface of biophysics, biochemistry, and materials science.
@ Max Planck Institute for Polymer Research, Mainz.
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
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 💊
Chemical Science @chemicalscience.rsc.org Flagship journal for @rsc.org. Open access, all topics in chemistry. chemicalscience-rsc@rsc.org 🌐 Website: rsc.li/chemscience
@michaelddennis.bsky.social @michaelddennis.bsky.social RS DeepMind. Works on Unsupervised Environment Design, Problem Specification, Game/Decision Theory, RL, AIS. prev CHAI_Berkeley
Sebastian Risi @risi.bsky.social Neuroevolution, Collective Intelligence, Self-organization
Jeff Clune @jeffclune.com Professor, Computer Science, University of British Columbia. CIFAR AI Chair, Vector Institute. Senior Advisor, DeepMind. ML, AI, deep RL, deep learning, AI-Generating Algorithms (AI-GAs), open-endedness. 
Arne Elofsson @handle.invalid Professor in bioinformatics, Stockholm University. Protein structure lover ( interactions predictions, evolution ..). Using machine learning as a part of AI for Sciences for halv my life. In addition to succén, I sometimes rants about sailing or skiing.
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
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
Bind Research @bindresearch.org Not-for-profit Focused Research Organisation (FRO) turning disordered proteins into viable drug targets | London, UK | https://bindresearch.org/
Thomas Löhr @tlhr.bsky.social Head of Compute / Co-founder @bindresearch.org | Simulations, Drug Design, Disordered Proteins
Garrett M. Morris @garrettmm.bsky.social Physicochemical deep learning, protein-ligand docking and scoring, computer-aided drug discovery and design, cheminformatics. All views my own. @morrislab@fediscience.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
Digital Chemistry Laboratory @dcl-ethz.bsky.social Digital Chemistry Laboratory at @ethzurich.bsky.social
Part of NCCR Catalysis and ETH AI Center
Led by @valencekjell.com
Accelerating chemical discovery with digital tools
Sifted @sifted.eu The leading media brand empowering startup Europe.
Read our articles here: https://sifted.eu/latest
Subscribe to our newsletter: https://sifted.eu/newsletters
Andrea Scarpino @andreascarpino.bsky.social Lead Computational Chemist at The Institute of Cancer Research.
📍 London, UK
#compchem #cheminformatics #drugdiscovery
Ahana (she/her) @ahana.bsky.social Reinforcement Learning PhD student, UPF Barcelona.
Uncertain in the face of optimism.
ahanadeb.com
Daniel Alvarez @daninthenet.bsky.social Senior Drug Designer | #AI Computational Medicinal Chemist | #medchem + #compchem | Also into #pottery and #oilpainting
Kirill Neklyudov @k-neklyudov.bsky.social Assistant Professor at Mila and UdeM
https://necludov.github.io/
Sam Rodriques @sgrodriques.bsky.social CEO of FutureHouse, building an AI Scientist