Çağrı Özsan @cagriozsan.bsky.social PhD Candidate in Medicinal Inorganic Chemistry🧫💊 @University of York
Eurovision Song Contest @eurovision.tv The Eurovision Song Contest is the world's biggest live music event - reaching nearly 200 million viewers
F.P. Morgan @ecfp.bsky.social cheminformatics @ všcht prague
https://molecular.beauty
github.com/dehaenw
CECAM @cecamevents.bsky.social Promoting fundamental research on advanced computational methods
Morris Wolf @morriswolf.bsky.social PhD on photoreversible polymers at Macromolecular Engineering Lab of ETH Zurich, Composer, 🌈
Science, art and music
morriswolf.ch
Chemical Science @chemicalscience.rsc.org Flagship journal for @rsc.org. Open access, all topics in chemistry. chemicalscience-rsc@rsc.org 🌐 Website: rsc.li/chemscience
Sébastien Darses @sebdarses.bsky.social Math Assoc. Prof. (on leave from France)
Research: Prob / Stat / Ant
Teaching Project (non-profit): https://highcolle.com/
https://sites.google.com/view/sebastien-darses/research?authuser=0
European Research Council (ERC) @erc.europa.eu European Research Council, set up by the EU, funds top researchers of any nationality, helping them pursue great ideas at the frontiers of knowledge. #HorizonEU
Open Free Energy @openfree.energy 
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
Adriano Rutz @adafede.bsky.social 
Jeff Guo @jeff-guo.bsky.social PhD student at EPFL working on generative molecular design | Previously Microsoft AI4Science and AstraZeneca
FACCTs @faccts.de FACCTs is bringing the ORCA quantum chemistry software to industry - promoting the next Quantum leaps in the Pharma, Materials and Chemical Industries.
Visit us at www.faccts.de
Karges Group @kargesgroup.bsky.social Full Professor in Biophysics at Faculty of Medicine, Ruhr University Bochum, Group Website: https://www.kargesgroup.ruhr-uni-bochum.de/
Angewandte Chemie @angewandtechemie.bsky.social Angewandte Chemie, a journal of the German Chemical Society (@gdch.de), is a leading journal in #chemistry published by Wiley-VCH (@wiley.com) in Weinheim, Germany
https://onlinelibrary.wiley.com/journal/15213773
@prof-ajay-jain.bsky.social @prof-ajay-jain.bsky.social 
Luciani Lab @luciani-lab.bsky.social Drug Delivery & Pharma Tech research @unibern.bsky.social🇨🇭| Co-founder PharmaBern | President CRS Local Chapter DeChAt | Vice-President Science Swiss Academy of Pharmaceutical Sciences SAPhW
Ben Burtenshaw @benburtenshaw.bsky.social Building tools for AI datasets. 😽
Looking in AI datasets. 🙀
Sharing clean open AI datasets. 😻
at https://bsky.app/profile/hf.co
Dr. Glaucomflecken @glaucomflecken.bsky.social Ophthalmologist. Comedian. Speaker. Jonathan.
Diego del Alamo @delalamo.xyz Computational protein engineering & synthetic biochemistry at Takeda
Opinions my own
https://linktr.ee/ddelalamo
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
Damiano Sgarbossa @damianosg.bsky.social PhD in Computational Biology & ML for Proteins @EPFL
https://sites.google.com/view/damiano-sgarbossa
Jannis Born @jannisblrn.bsky.social Research Scientist @IBM - AI for Scientific Discovery! Tech & sports enthusiast
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/
Adrian Mirza @adrian-mirza.bsky.social PhD student in Digital Chemistry at HIPOLE Jena
Bruno Rizzuti @brunorizzuti.bsky.social Computational biophysicist, affiliated to CNR (Italy) and BIFI (Spain). Currently simulating intrinsically disordered proteins, with other intrinsically disordered interests and passions. Homepage: biomolecules.eu 
Eric Boittier @ericboittier.bsky.social deep learning enjoyer, science evangelist
Science News @scinews.bsky.social Science News from Academic Journals etc.
Ho Leung Ng @ai-drugs.bsky.social AI/computational drug discovery. Consultant/scientific advisor. Former professor. Berkeley.
Wojciech Kopec @wojciechkopec.bsky.social Lecturer in Computational Pharmaceutical Chemistry at Queen Mary University of London | Visiting Scientist at the Max Planck Institute for Multidisciplinary Sciences | Computational Electrophysiology & Ion Channels
Poland->Denmark->USA->Germany->UK..?
Derek Ahneman @derekahneman.bsky.social AI for Chemistry @ IBM Research. Opinions my own.
Ed Griffen @griffen-ed.bsky.social husband, father, son, brother, computational medicinal chemist, anti-infective drug discovery, perpetually curious, apprentice akidoka, school governor @MedChemica, @covid_moonshot, @asap_discovery
Esben @cheminformania.com I like chemistry, computers and drug discovery. Sometimes blogs about cheminformatics, ML and neural networks for chemistry at cheminformania.com. Open source fanatic and science preprinter.
Kristina Ulicna @kristinaulicna.bsky.social AIxBio Research Scientist 👩🔬 | PhD Computational Biology 👩💻 | BSc Biomedicine 🧫 | "Singlecellologist" 🦠 into biologically meaningful representation learning 🧬 | Decoding life in London 🇬🇧
Travis T. York, Ph.D. (he/they) @travisyork.bsky.social Social Scientist, Education Researcher, Author, Advocate, Policy Wonk, & Association (NGO) Leader transforming Education & STEMM systems for ALL - Queer, 1st-Gen, Half-Indigenous, Foodie, Sailer, Boccer - posts are my own.
Dr Zoë Ayres @zjayres.bsky.social Trying to leave things better than I find them
Analytical Scientist 👩🔬 #AcademicMentalHealth advocate 🌱 Founder VoicesofAcademia.com 💬 Author of "Managing Your Mental Health During Your PhD" 📘 ADHDer 💚 Proud mum 👶 she/her. Views mine.
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🤔
J⌬vana V. Milic @jovanavmilic.bskyverified.social Scientist 🌍collaboration advocate🤝#interdisciplinary #research for smart & #sustainable (nano)technologies🧪⚡️💡as Associate #Prof at Uni Turku 🇫🇮 & Adolphe Merkle Institute🇨🇭invested in #Science4Policy&Diplomacy while 😷 m⌬m 🌐 www.jovanamilic.com
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
Magdalena Lederbauer @mlederbauer.bsky.social PhD student @MIT ChemE & CompSci
MSc ETH Chemistry @ETH Zurich
prev ML scientist @entalpicai
passionate about spectroscopy, improv theatre, and everything in between.
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)
Muneeb Sultan @mmsltn.bsky.social Building new things. Prev. genAI for proteins @abscibio., founding team @insitro, @Stanford PhD, and @Yale alumni. 🇵🇰🇺🇸
Matheus A. Meirelles @mmeirelles.bsky.social Synthetic/Medicinal Chemist 🇧🇷
Postdoc researcher at Universität Bern🇨🇭
Polaris @polarishub.io ML-ready datasets and benchmarks for drug discovery.
https://polarishub.io
Maedeh Darsaraee @maedehdarsaraee.bsky.social PhD student at the University of Bern in Cheminformatics @reymondgroup.bsky.social
Leon Rebhan @leondavinci.bsky.social PhD-student in organic synthesis/medicinal chemistry in Reymond Group
Love Alpinism 🏔 
@ziad-elmalki.bsky.social @ziad-elmalki.bsky.social Master student in Biological and Molecular Chemitry @EPFL
Passionate about computational chemistry/ Cheminformatics
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
Reymond Group @reymondgroup.bsky.social Research Group at DCBP UniBern
#Cheminformatics | #PeptideChemistry | #SmallMolecule | #DrugDiscovery | #OrganicSynthesis
@acscomp.bsky.social @acscomp.bsky.social 
American Chemical Society @acs.org ACS is home to the world’s scientific community — advancing, connecting, and empowering scientists.
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
Rebecca Neeser @rebeccaneeser.bsky.social PhD student @EPFL in Schwaller and Correia labs | previously @ETH Zurich and @MIT
Bruno Neri @neribr.bsky.social Technical Leader - Artificial Intelligence and Machine Learning Enthusiast - Senior Software Engineer https://www.linkedin.com/in/brunoneri
Peter Kenny @pwk2024.bsky.social Slayer of soucouyants but terrified of douens, centipedes and ceiling fans
Blog (Molecular Design): https://fbdd-lit.blogspot.com/
Grimme Lab @grimmelab.bsky.social Development and application of efficient computational chemistry methods - based @unibonn.bsky.social.
This account is managed by group members of Prof. Stefan Grimme.
COSMO Lab @labcosmo.bsky.social Computational Science and Modelling of materials and molecules at the atomic-scale, with machine learning.
Liz Decolvenaere @tallakahath.bsky.social Computational chemist with a focus on QM, Force Fields, and how ML can aid in both. Also: Cosplayer, LARP writer, birder, occasional science communicator, and several other things. She/they.
James Stevenson @allaboutchemist.bsky.social Research engineer for CBRN (chemical, biological, radiological, and nuclear) responsibility at Google DeepMind.
Machine learner and quantum mechanic.
https://orcid.org/0000-0003-0950-7775
Stephen J Jenkins @jnknssj.bsky.social Professor at Cambridge University, Fellow of St Edmund's College, Student of Everything Else. Posting in a personal capacity; opinions and photographs my own.
www.ch.cam.ac.uk/person/sjj24
orcid.org/0000-0001-9362-9665
Evan Spotte-Smith (they/them) @ewcss.info Ad Astra Fellow, Asst. Prof. of Digital Chemistry, @ucddublin.bsky.social |
Editor, @joss-openjournals.bsky.social |
Personal: ewcss.info |
Research group (@coreacter.org): CoReACTER.org |
ORCID: orcid.org/0000-0003-1554-197X |
All opinions mine
Élise Duboué-Dijon @elisedd.bsky.social CNRS researcher working at the Laboratoire de Biochimie Théorique (LBT), in the Institut de biologie physico chimique (IBPC) in Paris.
#RNA #Enzymes #compchem #molecularSimulations
Maren Podewitz @podewitzlab.bsky.social Chemist - exploring the world, now with a team.
@emmawolpert.bsky.social @emmawolpert.bsky.social 
Jarvist Moore Frost @jarvist.bsky.social To physicists: a chemist. To chemists: a physicist. To mathematicians: an empty set.
RSURF & Lecturer, Imperial College London.
Computational chemist / physicist.
Photovoltaics, batteries, antibacterial peptides; lasers, cryostats, (ML)(Q)MC/MD/TB/DFT.
Marcel Swart @marcelswart.bsky.social ▪️P @icreacommunity.bsky.social Prof TheoChem
▪️F @rsc.org
▪️M @acad-euro.bsky.social
▪️E @ica-papers.bsky.social
▪️ORCID: https://orcid.org/0000-0002-8174-8488
▪️🇳🇱 Views my own
▪️Pronouns: he/him/his
▪️Web: @marcelswart.eu
▪️See @spinstatepapers.bsky.social
Meagan Oakley @meaganoakley.bsky.social computational chemist. never met an actinide I didn't like
🇨🇦👩💻⚛ DKO Research Fellow @ University of Manchester
Sam Blau @samblau.bsky.social Research scientist & computational chemist at Berkeley Lab using HT DFT workflows, machine learning, and reaction networks to model complex reactivity.
Ben Blaiszik @benblaiszik.bsky.social Group Leader - AI and data infrastructure for science at
UChicago/Argonne/Globus - UofIllinois alum. materials, chemistry, physics. Opinions are my own.🤖🔬
Saeed Amirjalayer @samirjalayer.bsky.social Prof. of Computational Chemistry
Heisenberg-Prof. (DFG)
Interdisciplinary Center for Scientific Computing
Heidelberg University
agamirjalayer.iwr.uni-Heidelberg.de
samirjalayer.de
Bettina Keller @bettinagkeller.bsky.social Theoretical and Computational Chemistry, Professor @FU_Berlin
Jonas Verhellen @jonasverhellen.bsky.social Theoretical physicist with a PhD in neuroscience. Postdoc in protein-protein interactions. Into art, science, and innovation.
Currently: Copenhagen 🇩🇰
Previously: Oslo 🇳🇴, London 🇬🇧, Brussels 🇧🇪
Jonas Köhler @jonkhler.argmin.xyz web @ https://argmin.xyz
interests: machine learning, ai4science, algorithms, coding
member of technical staff @ https://cusp.ai
past @ MSR, DeepMind, MPI-IS
home @ Heimbach (Gilserberg), Berlin, Europe
born @ 353 ppm
block toxicity
he/him
Josh Pottel @jpottel.bsky.social Toddler/Baby Dad | Comp. Chemist | CEO | MolForecaster | previous: PDF @UCSF, PhD @McGillChemistry | 🇨🇦 | Montrealer | Sports fan | all opinions are my own.
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
Ewa Pastorczak @ewapastorczak.bsky.social Doing quantum chemistry at @p_lodz_pl
Grant Hill @dr-ghill.bsky.social Theoretical chemist. Research interests in optimisation (basis sets) and using AI/ML in sustainable chemistry
Teaching interests in digital chemistry and active learning
David Pfau @davidpfau.com So far I have not found the science, but the numbers keep on circling me.
Views my own, unfortunately.
Emma Chory, Ph.D. @chorye.bsky.social Assistant professor @ Duke University BME, guerilla knitter, pipettor of small volumes of liquid. Biologist masquerading as engineer, or the other way around. 
Ed Sherer @hartreefocker.bsky.social Executive Director of DSCS Digital Insights at Merck & Co., Inc.; comp chemist; firefighter; MN alum; Midwest born.
https://www.linkedin.com/in/ed-sherer-b6b5994
Mathias Christmann @christmann.bsky.social Professor of Chemistry 👨🔬 FU Berlin
https://www.bcp.fu-berlin.de/en/chemie/chemie/forschung/OrgChem/christmann/index.html
Loves Tool & learns Python #ChemSky
Sílvia Osuna @silviaosuna.bsky.social ICREA researcher working on the rational design of enzymes
Rommie Amaro @rommieamaro.bsky.social Professor at UC San Diego. Computational biophysics, biology, chemistry. Multiscale modeler. Viruses. Cancer. Co-Director of the Airborne Institute.
Gianni De Fabritiis @gdefabritiis.bsky.social Computer Simulations, Computational Intelligence, AI.
Research professor and interim CEO acellera.com.
Lab: www.compscience.org
Scholar: https://scholar.google.com/citations?hl=en&user=-_kX4kMAAAAJ&view_op=list_works&sortby=pubdate
Hannah Bruce @hannahbruce.bsky.social Computational Chemist
Charm Tx
Eats food, runs places, sits on sofa
Robin Corey @robincorey.bsky.social Assistant Professor in Pharmacology at University of Bristol | GPCRs and ion channels | molecular modelling and simulation | drugs and lipids
Bastian Bjerkem Skjelstad @skjelstad.bsky.social Computational chemist at Max Planck Institut für Kohlenforschung. Reaction mechanisms and catalysis
Simon Batzner @simonbatzner.bsky.social RS at at GDM, Science Team. Prev: Google Brain
Cory Simon @corymsimon.bsky.social applying math, computation, and machine learning to problems in chemical engineering | associate professor, Oregon State University | views mine
https://simonensemble.github.io/
Andy Cooper @aicooper.bsky.social Mostly science related. Occasional gardening to be feared. "Aren't you the guy who built that robot?"
Lisa Pecher @lisipea.bsky.social Coordinating manager of @gdch.de divisions | Formerly @angewandtechemie.bsky.social | PhD in computational chemistry | DE&I advocate | musician | nerdy about tea, board games, synthesizers, and sci-fi | 🏳️🌈 she/her (views are my own)
Martin Rahm @rahmlab.bsky.social Professor of Theoretical Chemistry at Chalmers University of Technology in 🇸🇪 interested in chemical bonding, material prediction, and astrobiology. www.rahmlab.com
Adrian Roitberg @adrianroitberg.bsky.social Tries to pass as a computational chemist. Bostero fanatic. He/Him. Comments are my own and do not reflect my institution.
Jan Hermann @hrmnn.net Computational chemistry & physics, electrons, deep learning 🚲☕️♟️ Microsoft Research AI for Science · https://hrmnn.net
Vera Krewald @verakrewald.bsky.social Quantum Chemistry at TU Darmstadt
Interested in unpaired electrons and their shenanigans, especially in transition metal complexes, catalysis, electron transfer, magnetism and photochemistry
Fernanda Duarte @fjduarte.bsky.social Computational Chemist. Associate Professor at the University of Oxford. Organic Chemistry Fellow at Hertford College. 🇨🇱
Tim Green @tfgg.me Research Engineer at Google DeepMind. AlphaFold, LLMs, Physics and Civic Tech. tfgg.me
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