Computational Chemistry Papers @compchem-papers.bsky.social Hi! I'm an automated bot surveying the literature for Comp Chem articles using the open source PapersBot. Maintained by @digichem.bsky.social
Achira @achira-ai.bsky.social Achira is building atomistic foundation simulation models to power the future of drug discovery.
http://achira.ai
Open Research and Public Engagement Roadmap @engagedroadmap.bsky.social Co-Creating Ireland's Public Involvement in Open Research Roadmap
ENGAGED is building a national roadmap to shape public involvement in open research in Ireland. We believe that research can and does play an important role in tackling societal challenges.
DurrantLab @durrantlab.bsky.social Comp bio lab @ Pitt. Makes & applies tools for pharm & basic-science research. Cheminformatics, MD simulations, visualization, computer docking.
Open Babel @openbabel.org Open source cheminformatics toolkit
Cédric Bouysset @cedric.bouysset.net Cheminformatics, Open-source software, Machine-learning 🤖 Developer of ProLIF and mols2grid 🐱💻 Bass and video games 🎸🎮 Oxford, UK
Avogadro Project @avogadro.cc Advanced molecule editor and visualizer
Building the next generation of molecular and materials visualization and editing tools
https://avogadro.cc/
https://discuss.avogadro.cc/
Nature Reviews Chemistry @natrevchem.nature.com A chemistry journal published by SpringerNature
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Nature Chemical Biology @natchembio.nature.com A scientific journal devoted to publishing the most compelling research, opinion and analysis at the intersection of chemistry and biology.
Nature Chemistry @natchem.nature.com A chemistry journal for cutting-edge research and analysis from @natureportfolio.nature.com. Account run by @nchemgav.bsky.social and @joansp.bsky.social
https://www.nature.com/nchem/
Nature Machine Intelligence @natmachintell.nature.com A Nature Research journal on AI, robotics and machine learning
@natureportfolio.bsky.social
nature.com/natmachintell
Communications Biology @commsbio.nature.com An open-access @natureportfolio.bsky.social journal publishing high quality primary research, reviews and commentary in all areas of the biological sciences since 2018.
https://www.nature.com/commsbio/
Nature Reviews Neurology @natrevneurol.nature.com Nature Reviews Neurology is a clinical review journal from Springer Nature. Follow us for the latest updates in neurology from the journal and beyond. www.nature.com/nrneurol
Stanford University Press @stanfordpress.bsky.social Stanford University Press has been publishing books across the humanities, social sciences, law, business, and other areas since 1892.
Nature Portfolio @natureportfolio.nature.com Nature Portfolio’s high-quality products and services across the life, physical, chemical and applied sciences is dedicated to serving the scientific community.
Nature @nature.com Research, news, and commentary from Nature, the international science journal. For daily science news, get Nature Briefing: https://go.nature.com/get-Nature-Briefing
Open Force Field @openforcefield.org 
Open Free Energy @openfree.energy 
Cole Group @colegroupncl.bsky.social We are a computational research group at Newcastle University led by #UKRIFLF Dr Danny Cole specialising in atomistic simulations in medicinal chemistry and biology https://blogs.ncl.ac.uk/danielcole/
Rocco Meli @rmeli.bsky.social RSE at CSCS (Swiss National Supercomputing Center) | MDAnalysis Core Developer | JOSS Editor | Interested in #HPC, Computational Chemistry, and Materials Science
Jeffery Pendleton @jefferypendleton.bsky.social Psychology PhD Candidate
University of Cambridge
🏛️Anthropologist 🔤Linguist 🧠Psychologist
📧 jrlp2@cantab.ac.uk message for collabs
I do research in Mental Time Travel, Linguistic Relativity, & Schizotypy while sharing my PhD life with the general public😁
Science Events @scievents.bsky.social Science Events helps you organise a scientific conference or workshop. Use our platform to organise your next event! Visit our platform at https://www.sci.events
Life Science Network @lifesciencenet.bsky.social A platform for life sciences. Publications, research protocols, news, events, jobs and more. Sign up at https://www.lifescience.net.
Diamond Industrial Liaison Group @diamondilo.bsky.social The Industrial Liaison Team partners with industry to turn complex challenges into insight using Diamond’s advanced synchrotron science. Our expert scientists guide, support, or deliver experiments, offering flexible services for new and experienced users.
Memorial Sloan Kettering Cancer Center @mskcancercenter.bsky.social Where you're treated first, matters. To make an appointment: 833-637-6698
OMSF @omsf.io the Open Molecular Software Foundation is dedicated to the creation and implementation of the latest and greatest open comp.chem software.
Institute for Protein Design @uwproteindesign.bsky.social We create proteins that solve modern challenges in medicine, technology, and sustainability.
• 2024 Nobel Prize in Chemistry
• University of Washington, Seattle
→ ipd.uw.edu
EMBL-EBI @ebi.embl.org EMBL's European Bioinformatics Institute (EMBL-EBI) provides open biological data resources and tools, and performs basic research in computational biology. https://www.ebi.ac.uk/
Columbia Systems Biology @columbiasysbio.bsky.social Department of Systems Biology @Columbia University VP&S
systemsbiology.columbia.edu
Diamond Light Source @diamondlightsource.bsky.social Diamond Light Source is the UK’s national synchrotron science facility, located at the Harwell Science and Innovation Campus in Oxfordshire.
C&EN (Chemical & Engineering News) @cenmag.bsky.social https://cen.acs.org/
Sharing the world of #chemistry: News🗞 Research⚗️ Infographics #PeriodicGraphics ℹ Pictures #CENChemPics 📷 Comics #SketchChemistry 🗯 #FluorescenceFriday ❇️
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.
Nessa Carson @supersciencegrl.co.uk Digital chemist & chemistry automation nerd | Lives in a historical canalside cottage | Learner of comp chem and Swedish | Views are mine | She/they. Macclesfield, UK
Albert Vilella, PhD. @albertvilella.bsky.social Bioinformatics Scientist / Next Generation Sequencing, Single Cell and Spatial Biology, Next Generation Proteomics, Liquid Biopsy, SynBio, AI/ML in biotech // http://albertvilella.substack.com
The Matter Lab @thematterlab.bsky.social The materials for tomorrow, today.
We are the Matter Lab at the University of Toronto, led by Professor Alán Aspuru-Guzik. Our group works at the interface of theoretical chemistry with physics, computer science, and applied mathematics.
MIT Department of Chemistry @mitchemistry.bsky.social MIT Chemistry shares in the tradition of MIT excellence by pioneering discoveries and advances in chemical research, from polymer synthesis to medical imaging.
MIT Technology Review @technologyreview.com Our in depth reporting on innovation reveals and explains what’s happening now to help you know what’s coming next.
Find our journalists on Bluesky: https://bsky.app/starter-pack/technologyreview.com/3lar7fofuwl2n
MIT Chemical Engineering @mitcheme.bsky.social Latest news from MIT ChemE
MIT Press @mitpress.bsky.social Committed to the daily re-imagining of what a university press can be since 1962.
Website: https://mitpress.mit.edu
The Reader (our home for excerpts, essays, & interviews): https://thereader.mitpress.mit.edu
MIT Press Direct: https://direct.mit.edu/
ICLR Conference @iclr-conf.bsky.social International Conference on Learning Representations https://iclr.cc/
Joey Bose @joeybose.bsky.social Incoming Assistant Professor @Imperial College London. Post-doc @UniofOxford. Into Geometry ∩ Generative Models. @mila-quebec.bsky.social Affiliate member. Phd from @mila-quebec.bsky.social / McGill.
website: https://joeybose.github.io/
@jeremywohlwend.bsky.social @jeremywohlwend.bsky.social 
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/
AI x Bio Discovery @aixbiobot.bsky.social Automated discovery of AI x Bio papers, blogs, and news.
Yoshua Bengio @yoshuabengio.bsky.social Working towards the safe development of AI for the benefit of all at Université de Montréal, LawZero and Mila.
A.M. Turing Award Recipient and most-cited AI researcher.
https://lawzero.org/en
https://yoshuabengio.org/profile/
Nate Corley @ncorley.bsky.social PhD Candidate @ the University of Washington's Institute for Protein Design | Baker Lab | Machine Learning for Protein Design | Enzymes
Mohammed AlQuraishi @moalquraishi.bsky.social MLing biomolecules en route to structural systems biology. Asst Prof of Systems Biology @Columbia. Prev. @Harvard SysBio; @Stanford Genetics, Stats.
Joe Greener @jgreener64.bsky.social Computational chemist/structural bioinformatician working on improving molecular simulation at MRC Laboratory of Molecular Biology. jgreener64.github.io
Hannes Stark @hannes-stark.bsky.social MIT PhD Student - ML for biomolecules - https://hannes-stark.com/
Eva Smorodina @evasmorodina.bsky.social Computational structural biologist
Boston Protein Design and Modeling Club @bpdmc.org We are a global community of computational protein engineers and modelers from both academia and industry.
An @omsf.io project organized by @cdbahl.com, @sokrypton.org, and @nickpolizzi.bsky.social
https://bpdmc.org
MIT Jameel Clinic @aihealthmit.bsky.social Official BlueSky account for the epicenter of AI and health at MIT.
www.jclinic.mit.edu
Follow us on X, LinkedIn, and Instagram!
Recursion @recursionpharma.bsky.social Decoding biology to radically improve lives. The industrial revolution of drug discovery is here. Learn more at recursion.com #techbio
Gabriele Corso @gcorso.bsky.social PhD student @MIT • Research on Generative Models for Biophysics and Drug Discovery
Prescient Design @prescientdesign.bsky.social A Genentech Accelerator
gene.com/prescient
https://scholar.google.com/citations?user=HVfvEVoAAAAJ
Edouard Leurent @eleurent.bsky.social Gemini Pretraining @Google DeepMind, Research Scientist. Birds, poetry, games, robots
📍London 🔗 edouardleurent.com
Lei M. Zhang @l32zhang.bsky.social Research Scientist @ Google DeepMind. Previously @ OpenAI. Building AGI. 🤖
Mikayel Samvelyan @samvelyan.com Research Scientist @ Google DeepMind. Previously Meta (FAIR), Reddit, PhD UCL, MSc Oxford. samvelyan.com
Murray Shanahan @mpshanahan.bsky.social Professor at Imperial College London and Principal Scientist at Google DeepMind. Posting in a personal capacity. To send me a message please use email.
Anselm Levskaya @levskaya.bsky.social Doing spooky things with linear algebra.
karpathy @karpathy.bsky.social AI @ OpenAI, Tesla, Stanford
Keith Hornberger @krhornberger.bsky.social med chem @ Arvinas | PhD @ Columbia | hiker | cocktail enthusiast | he/him/huz/dad | dreaming of Sedona | while I have a connection to Arvinas, all opinions expressed are my own and do not represent the views, opinions, or positions of the company
MRC Laboratory of Molecular Biology @mrclmb.ac.uk The MRC Laboratory of Molecular Biology aims to understand biological processes at the molecular level to help tackle human health problems and disease.
Obsidian @obsidian.md The free and flexible app for your private thoughts. For help and deeper discussions, join our community: http://obsidian.md/community
Cambridge Biomedical Campus @cambridgebiocampus.bsky.social 
Stephen Bonner @sbonner0.bsky.social Machine Learning for Drug Discovery at AstraZeneca
Anshul Kundaje @anshulkundaje.bsky.social Genomics, Machine Learning, Statistics, Big Data and Football (Soccer, GGMU)
Zachary Wu @zacharywu.bsky.social Researcher at Google DeepMind. Previously Arnold group at Caltech. Making useful molecules!
Doudna Lab @doudna-lab.bsky.social News from Jennifer Doudna's lab at UC Berkeley, Innovative Genomics Institute. Tweets from lab members and not Jennifer Doudna unless signed JD. Tweets represent personal views only.
doudnalab.org
American Chemical Society @acs.org ACS is home to the world’s scientific community — advancing, connecting, and empowering scientists.
Nobel Prize @nobelprize.org The official Bluesky account of the Nobel Prize.
Celebrating the work and discoveries that have had the greatest benefit to humankind.
Science Magazine @science.org Cutting-edge research, news, commentary, and visuals from the Science family of journals. https://www.science.org
Noelia Ferruz @noeliaferruz.bsky.social Generative models for protein design.
Group leader at CRG
Simon Mathis @simonmathis.bsky.social PhD student at Uni of Cambridge, UK 🔬 | AI for protein design & engineering 🧬 | biotech & environmental applications 🌱 | enzymes 🏗️
🇦🇹🇨🇭
Jeff Ruffolo @jeffruffolo.bsky.social Protein Design / ML @ Profluent Bio | Molecular Biophysics PhD @ Johns Hopkins
Caltech Division of Chemistry and Chemical Engineering @caltechcce.bsky.social Learn more about the extraordinary research underway in the Division of Chemistry and Chemical Engineering at the California Institute of Technology.
ML for Protein Engineering Seminar @ml4proteins.bsky.social Seminar series on machine learning for protein engineering. Details for seminars and slack are on our website. DM us if you're interested in presenting! ml4proteinengineering.com
Possu Huang Lab @possuhuanglab.bsky.social Our lab uses experimental and computational methods to design de novo proteins | @Stanford
RentmeisterLab @rentmeisterlab.bsky.social Researcher in Chemical Biology, Professor at LMU Munich
https://www.rentmeister-group.com/
Foto: LC Productions
National Academy of Sciences @nasonline.org As advisors to the nation, we recognize and advance outstanding science for the benefit of society. Journals: @pnas.org and @pnasnexus.org | President: Neil Shubin (@neilshubin.bsky.social)
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.
Michael Bronstein @mmbronstein.bsky.social DeepMind Professor of AI @Oxford
Scientific Director @Aithyra
Chief Scientist @ProximaBio
ML Lead @ProjectCETI
geometric deep learning, graph neural networks, generative models, molecular design, proteins, bio AI, 🐎 🎶
Frances Arnold @francesarnold.bsky.social Engineer/scientist, Nobel Prize in Chemistry 2018
I love evolution, enzymes, protein engineering, AI
Linus Pauling Professor at Caltech
Siewert-Jan Marrink @cg-martini.bsky.social Martini lover.
Shaken, stirred, or self-assembled.
https://cgmartini.nl/
Marc Appis @marclappis.bsky.social European 🇪🇺 | #Berlin 🏠 | PhD student in medical systems biology 🧬 with @leifludwig.bsky.social | Cooking & mountains
Science HR @sciencehr.bsky.social A career network featuring science jobs in academia and industry.
Visit our platform at www.science.hr
Robin Corey @robincorey.bsky.social Assistant Professor in Pharmacology at University of Bristol | GPCRs and ion channels | molecular modelling and simulation | drugs and lipids
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.
pen(Taka) @iwatobipen.bsky.social Medicinal Chemist, Cheminformatician, Runner and ?
Peter Kenny @pwk2024.bsky.social Slayer of soucouyants but terrified of douens, centipedes and ceiling fans
Blog (Molecular Design): https://fbdd-lit.blogspot.com/
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
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)
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
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.
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.