Computational chemist, scientific software developer (Amber/CHARMM), author of CPPTRAJ.
@piermorgante.bsky.social
#MachineLearning editor at @iopp-mlresearch.bsky.social (@ioppublishing.bsky.social). Theoretical chemist. LEGO fan. #DFT #compchem #chemistry #DogsofCompChem #Quantum Proud member of #ChemSky Personal+work account (all views my own) 📍Buffalo, NY
@mfernandezquintero.bsky.social
Staff Scientist, The Scripps Research Institute, passionate about protein dynamics, protein design, structural biology of glycoproteins and antibodies, enthusiastic about music and 🐰
@anubhav00.bsky.social
Grad student in computational chemistry. Into movies, food, and science.
@krapnik.bsky.social
theoretical physical chemist, molecular modeller and chem- and bioinformatician - #AlphaFoldology enthusiast Palacky University Olomouc, ORCID:0000-0001-9472-2589 #boardgamegeek (tweets my own) #ELIXIRCZ
@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)
@martinstoermer.bsky.social
I do Medicinal Chemistry for viral proteases. Ginger cat and golden retriever dad. Football and non-cycling cycling fan. Chronic pain and immune compromised scientist on the slippery slope to retirement. 📍Brisbane, Queensland, Australia
@georgetakei.bsky.social
I’ve boldly gone into the clear blue yonder. Follow for more recipes and tips.
@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
@skepteis.bsky.social
Computer scientist, Bioinformatician, PhD in Chemistry and Molecular Sciences. Working on the above as an Assistant Prof at WUR. Interested in all the sciences. Materialist. Fan of cats, Punk Rock, and Hockey.
@aspuru.bsky.social
Professor of Chemistry and Computer Science University of Toronto Faculty member, Vector Institute Director, Acceleration Consortium Senior Director of Quantum Chemistry NVIDIA My views expressed here are personal and are not those of my employers.
@peonor.bsky.social
Chemist, husband, father, singer. Sustainability, catalysis, stereochemistry, predictive modeling. Senior Principal Scientist @astrazeneca.bsky.social Gothenburg. he/him
@martinvoegele.bsky.social
Computational Biophysicist, Amateur Photographer, History+Language Nerd. All views my own. Website: https://martinvoegele.github.io/
@andrewrosen.bsky.social
Assistant Professor at Princeton. Quantum-chemical engineer and materials designer. https://rosen.cbe.princeton.edu
@chhdellago.bsky.social
Physicist, professor @univie.ac.at, director of @esivienna.bsky.social, computational physics, statistical mechanics, machine learning, soft matter, biking, hiking, skiing, *320 ppm. 🇪🇺
@gabegomes.bsky.social
autonomous science & digital molecular designer | assistant professor @cmu with @gpggrp.bsky.social | https://gpggrp.com | https://aithera.ai | h(e/im), views my own
@jelfschem.bsky.social
Professor in Computational Materials Chemistry at Imperial College (she/her).
@pwk2024.bsky.social
Slayer of soucouyants but terrified of douens, centipedes and ceiling fans Blog (Molecular Design): https://fbdd-lit.blogspot.com/
@geoffhutchison.net
Chemist, Scientist, Husband, Dad, Runner, Teacher. I develop Avogadro + OpenBabel to find new materials for energy applications @Pitt_Chemistry he/him
@zwijcompchem.bsky.social
Engineer pretending to be a Computational Chemist working on how light and stuff interact at University College London - husband of @jelfschem.bsky.social - all views are my own 🇳🇱🇪🇺🇬🇧
@anunesalves.bsky.social
Computational biochemist (ligand binding kinetics, crowding) Junior group leader at the Technical University Berlin Associate editor at the Journal of Chemical Information and Modeling Brazilian in Germany
@pschwllr.bsky.social
Assistant Professor at EPFL, ML/AI-accelerated Chemistry & Synthesis | Educating the next generation of chemists and leading a fantastic team (https://schwallergroup.github.io) | Previously IBM Research / Uni Bern / Uni Cambridge / EPFL | he/his
@vlderinger.bsky.social
Computational chemist, curious about the atomic-scale structure of materials & ML for chemistry. Associate Professor at the University of Oxford
@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.
@guillemsimeon.bsky.social
(He/him) Physicist. Machine learning and atoms @ Microsoft Quantum. Barcelona. 🏳️🌈
@christophjacob.eu
Professor for Theoretical Chemistry at TU Braunschweig http://www.christophjacob.eu
@gjpvwesten.bsky.social
KNCV Gold Medal 2023. Exploring drug space with AI 💪, Professor of AI & Med Chem in Leiden, Computational Drug Discovery, http://cddl.nl, Opinions are my own.
@bernadsz.bsky.social
Nature lover. Curious turned scientist. Part of the ORCA development team. Now bringing Quantum Theory and Molecular Physics to the real world at @faccts-orca.bsky.social https://scholar.google.com.br/citations?user=U6szjgMAAAAJ&hl=pt-BR
@mcs07.bsky.social
Software and cheminformatics for drug discovery. Working at D. E. Shaw Research.
@thiagoreschutz.bsky.social
A chemical engineer that likes inverse design/modeling, dynamical systems, neural networks, thermodynamics, statistics etc. (whatever etc. means) 🇧🇷🇺🇾
@dermewes.bsky.social
Scientist, chemist, brewer, and dad working on the holy deep-blue grail of #OLED because: "Computers don't invent molecules, humans do!"
@handle.invalid
Trying to teach computers how to design materials. Leading a research group at FSU Jena/HIPOLE Jena. Increasing entropy since 1996.
@labcosmo.bsky.social
Computational Science and Modelling of materials and molecules at the atomic-scale, with machine learning.
@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.
@allaboutchemist.bsky.social
Quantum mechanic & machine learner. Senior principal scientist at Schrödinger, Inc. Sometimes a professor at The Cooper Union. https://orcid.org/0000-0003-0950-7775
@jnknssj.bsky.social
Professor at Cambridge University, Fellow of St Edmund's College, Student of Everything Else. Posting in a personal capacity. www.ch.cam.ac.uk/person/sjj24 orcid.org/0000-0001-9362-9665
@ewcspottesmith.bsky.social
Incoming Asst. Prof., ChemE, Carnegie Mellon University | Editor, @joss-openjournals.bsky.social | Personal: espottesmith.github.io | Research group (@coreacter.org): coreacter.org | orcid.org/0000-0003-1554-197X | All opinions mine
@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
@micaelamatta.bsky.social
#compchem | organic semiconductors | functional biomaterials | polymers | @mdanalysis core dev | made in Sardinia 🏳️🌈 she/her
@johnparkhill.bsky.social
Senior director of machine learning @ Terray Therapeutics (https://www.terraytx.com/). Father. NSF CAREER award giver-upper. Gibe and gambol enjoyer. Refugee from https://x.com/j0hnparkhill. http://bbgky.net
@sukritsingh92.bsky.social
Biophysicist｜Damon Runyon QB & NCI Early Stage K99/R00 Fellow at MSKCC w/ @jchodera.bsky.social | Team @foldingathome.org | PhD with @drgregbowman.bsky.social | Drug resistance, Protein dynamics, Dogs, Games My website: https://sukritsingh.github.io
@greglandrum.bsky.social
Cheminformatician, developer, climber, runner, hiker, cook ORCID: 0000-0001-6279-4481
@arwalker.bsky.social
Assistant professor of computational chemistry at Wayne State University (Detroit). Computational simulations of fluorescent biomolecules. PhD@Cisneros, PD@Martinez #bifurious
@sacquin-mo.bsky.social
CNRS research director modelling #Proteins. Lab. Biochimie Théorique UPR9080, IBPC #WomanInSTEM Website: http://www-lbt.ibpc.fr/people/sacquin Popularization blog (in french): https://topoftheprots.com/
@letigonzalez.bsky.social
🇪🇸 Chemist • Professor at University of Vienna • Theoretical chemistry, quantum chemistry, excited-state dynamics • Home of SHARC 🦈 Senior Editor of ACS Central Science • Board of Directors, Cluster of Excellence MECS ☀️ She/her/wife/Mom of 2