A community led collection of recipes, build infrastructure and distributions for the conda package manager.
https://conda-forge.org
Assistant Professor at the University of Zurich.
🖥️ protein design, machine learning🤖, crystallography💎, cryoEM🔬. Avid weirdness connoisseur 🎩
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
We are the largest biomedical science hub in the south of Europe, by the beach in Barcelona.
Recerca biomèdica amb vistes |
@researchmar.bsky.social @crg.eu @melisupf.bsky.social @embl.org @isglobal.org @ibe-barcelona.bsky.social @fpmaragall.bsky.social
PhD Student in quantum foundations and quantum information
Chemistry graduate student: drugs, lipids, and computers.
Train traveller.
Born at 361 ppm.
🇨🇿 🇪🇺 he/him
Martini lover.
Shaken, stirred, or self-assembled.
https://cgmartini.nl/
Molecular Dynamics Data Bank. The European Repository for Biosimulation Data.
Funded by the European Union
www.mddbr.eu
Dpt. for #MolecularSociology @mpibp.bsky.social
https://www.biophys.mpg.de/molecular-sociology
Our research concerns biological membranes with particular emphasis on the structure and function of membrane proteins.
#Biophysics #cryoEM #structuralbiology
Prof of Computational Microbiology. Oxford Biochemistry & St Anne’s College. Bacterial Cell Envelopes. LFC fan 🌈
Senior Editor at Nature Chemical Biology handling #glycotime, #lipidtime, immunology, microbiology, protein engineering, #synbio, #computational. Formerly a comp chemist simulating various things. Based in DC.
PhD student @EPFL 🇨🇭
ML & computational biology 🤖🧬⚛️
Associate professor at the University of Milano.
Biophysics and computational structural biology.
http://compsb.unimi.it
Developer @plumed.org
https://orcid.org/0000-0002-9923-8590
👩🔬 The Institut Pasteur is a leading global biomedical research institute.
🔬 Explore with us the frontiers of biomedical research
🧪 Follow us to uncover groundbreaking discoveries
🌍 Join a community passionate about progress and open science
PhD student Technische Universität Berlin #ComputationalChemistry #VibrationalSpectroscopy 🇦🇷 in 🇩🇪
Postdoc @ Daniel Cole group, Newcastle University. Computational Chemistry.
Scientific animator, structural biologist, creator of #MolecularNodes bradyajohnston.github.io/MolecularNodes/
Associate Professor of Computational Chemistry, University of Birmingham
https://www.grynova-ccc.org/
views my own
Advanced molecule editor and visualizer
Currently working towards Avogadro2
https://two.avogadro.cc/
https://discuss.avogadro.cc/
A scientific journal devoted to publishing the most compelling research, opinion and analysis at the intersection of chemistry and biology.
Centre of Excellence for Computational Biomolecular Research
Soft active matter | DPhil Theoretical Physics @Oxford | EPFL | BEA | StuSti
PhD at EPFL | Biophysics and Machine Learning
Associate Professor at Charles University | Protein & RNA structural bioinformatics |Protein annotation (sequence & structure)
https://bioinformatics.cuni.cz/hoksza/
MIT PhD Student - ML for biomolecules - https://hannes-stark.com/
Chemist, Scientist, Husband, Dad, Runner, Teacher. I develop Avogadro + OpenBabel to find new materials for energy applications @Pitt_Chemistry he/him
laboratory on structure and functions of living membranes lab at University of Virginia ; also posts occasional nonsense - views our own, not UVA
www.levental-lab.com
Organizing the largest workshop concerning Free Energy calculations within the United States.
Theoretical physicist (quantum information + quantum thermodynamics) at QuICS, author of Quantum Steampunk: The Physics of Yesterday's Tomorrow
Exploring the foundations of physics and cosmology with Zeeya Merali and Gabe Fitzpatrick, of the Foundational Questions Institute, FQxI, the physics think tank and funding agency.
Theoretical chemistry group UCB_Chemistry, working in the areas of quantum dynamics and nonequilibrium statistical mechanics http://www.cchem.berkeley.edu/dtlgrp/
Postdoctoral Researcher @Sabanci University - comp bio
https://mberksoz.github.io/
Computational biophysicist
Computational chemist/structural bioinformatician working on improving molecular simulation at MRC Laboratory of Molecular Biology. jgreener64.github.io
A leading life science journal that champions high-impact research across all disciplines—from molecules to ecosystems. We offer innovative formats and collaborative editorial support to ensure your work achieves its full scientific impact.
PLOS is a non-profit organization on a mission to drive open science forward with measurable, meaningful change in research publishing, policy and practice.
ASAP uses artificial intelligence and computational chemistry to accelerate structure-based open science antiviral drug discovery and deliver oral antivirals for pandemics with the goal of global, equitable, and affordable access.
MLing biomolecules en route to structural systems biology. Asst Prof of Systems Biology @Columbia. Prev. @Harvard SysBio; @Stanford Genetics, Stats.
Professor and Dean of The Rockefeller University. Cell biologist in NYC. Believer in the power of science education.
International research centre devoted to curing #cancer and other diseases linked to #aging. @cerca.cat center, member of @bist.eu.
www.irbbarcelona.org
Associate Professor in the School of Biological Sciences at the University of Southampton, head chef at https://GlycoShape.org, Salem's butler, fucose fanatic #glycotime everyday! She/Her
Theoretical Chemistry research group @lct-umr7616.bsky.social, Sorbonne Université & CNRS| Led by Prof. Piquemal (@jppiquem.bsky.social)|
#compchem #HPC #MachineLearning #quantumcomputing
Website: https://piquemalresearch.com
ACS Publications is proud to publish the most trusted, most cited, and most read collection of journals in the chemical and related sciences.
Explore ACS Publications, a division of @acs.org: pubs.acs.org
🧪 Infographics exploring everyday chemistry
📅 #PeriodicGraphics in @cenmag.bsky.social
🥇 ACS 2025 Interpreting Chemistry for the Public award
🏆 ABSW 2018 Science Blog Award
🖊️ Posts by @andy.compoundchem.com
🌐 Website: compoundchem.com
Front-end developer, driven by design.
Former lead front-end @ cher-ami.tv.
Musician, drummer.
Based in Lyon, France.
Freelancer
↳ https://willybrauner.com
↳ https://github.com/willybrauner
#POLYMATsptl - San Sebastian International Workshop on Macromolecular Materials http://polymat-spotlight.eu
Computational protein research group of Prof Ben Corry.
We love molecular dynamics and all kinds of membrane proteins including ion channels, transporters and immune receptors
~Posts by group members
AI/ML for Science & DeepTech | PI of the AI for Materials Lab | Prof. of Physics at UAM. https://bravoabad.substack.com/
Senior data scientist in computational structural biology, protein dynamics and cryoem | Marie Sklododowska-Curie fellow w Jose Maria Carazo and Carlos Oscar Sorzano | postdoc w Ivet Bahar
Molecular modeling, simulations, metadynamics, machine learning
existing somewhere between neuroscience and biochemistry
australian in copenhagen
Research group at University of Illinois, Urbana-Champaign.
Postdoc @rockefeller. Making cryoEM into a tool for RNA biophysics one molecule at a time.
Postdoc in Filizola Lab @ ISMMS | Voelz lab + Folding@home alum | Muay Thai
CompChem at Stealth, previously @nestedtx, @voelzlab and @foldingathome
(he/him)
Hirschfelder Chair, Professor of Chemistry, University of Wisconsin-Madison, Director, Theoretical Chemistry Institute, Theoretical chemistry and Biophysics, previously at HKUST, https://huang.chem.wisc.edu/
I’m here to discuss Mathematics, Research Software Engineering, Machine Learning and #HPC.
I was @walkingrandomly on twitter
Now a Community Developer Advocate at MathWorks.
Author of The MATLAB Blog.
I work with soft matter and ride a brakeless track bike
Scientist (🇨🇦) lucky to have a great group of researchers (🇨🇵) using big magnets for atomic-level insight on proteins & RNA, IDPs and DNA structures. INSERM scientist (French National Institute of Health and Medical Research) located at Univ. Bordeaux.
Protein biophysicist working on intrinsically disordered proteins in neuroscience and biotech. Assoc. prof at @MolBiolAU and @PromemoAU. (He/Him)
Curvenote's mission is to free science from static PDF documents to enable researchers to continuously share more interactive, reproducible, and richly-linked #openscience content. Curvenote develops authoring and publishing tools for researchers.
I talk about computational #openscience communication and science publishing. On the jupyterbook.org & @mystmd.org teams, co-founder of @curvenote.com & @continuous.foundation.
Markdown with superpowers for writing scientific 👨🔬 and technical 📈papers. #OpenSource & maintained by Project #Jupyter.
iOS Developer, father, and a bunch of other normal stuff...
Not a HPC Guru, but I play one on social media
🇫🇷Theoretical & Computational Chemist ⚛️🧪🖥️🧬| #CompChem | #CompBio | #HPC | #ChemSky | #CompChemSky| #University | #Chemistry | #BioChemistry | #ESR | #URCA | #ComESR | #VeilleESR | #VeilleEN
Personal account💻📱
🧐Reposts are reflections, not endorsements🤔
Nanoscience and Molecular Materials Group of the Spanish Chemical and Physical Royal Societies http://www.genam.rseq.org
🧬 Structural Bioinformatics | 💊 AI/ML for Drug Discovery | Geometric DL
🔬 @iocbprague.bsky.social, prev. PhD @cusbg.bsky.social @mff.unikarlova.cuni.cz
#scicomm #sciart. PhD Chemist, 3D artist and animator, bringing you images and videos of science (covers, video, web content etc.)
message me if you need visuals to promote your work💊🐡🧫🧪⚗️🧶🧬
www.scicommstudios.co.uk, https://www.youtube.com/@SciCommStudios
Dynamic protein designer @uwproteindesign.bsky.social
Assistant Project Scientist | Rommie Amaro's lab - UC San Diego.
Computational biophysicist.
Bioinformatics Scientist / Next Generation Sequencing, Single Cell and Spatial Biology, Next Generation Proteomics, Liquid Biopsy, SynBio, AI/ML in biotech // http://albertvilella.substack.com
#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/
🏳️🌈 NVIDIA & Duke. Was Allianz, VantAI, TUM. BioCS+ML dude.
Lab page: https://machine.learning.bio
GScholar: https://scholar.google.com/citations?user=4q0fNGAAAAAJ
The Laboratoire de Chimie Théorique (LCT) is a joint
@sorbonne-universite.fr & @cnrs.fr Research Center (UMR 7616) dedicated to Theoretical & Computational Chemistry (Paris, France).
#compchem #compchemsky #chemsky
1. A blog to help chemists find jobs. (chemjobber.blogspot.com) 2. Towards a quantitative understanding of the quality of the chemistry job market
Chief Science and Strategy Officer, openRxiv. Co-Founder, bioRxiv and medRxiv.
Computational protein engineering & synthetic biochemistry at Takeda
Opinions my own
https://linktr.ee/ddelalamo
Principal Researcher in BioML at Microsoft Research. He/him/他. 🇹🇼 yangkky.github.io
Computational structural biologist @Fox Chase Cancer Center. Gay, out & proud since 1986. I support transgender & nonbinary people. Living with CLL/SLL. Video about my LGBTQ+ life in science: https://tinyurl.com/45srzjdw. Views my own, not my employer's.
Scientist at ICREA and IRB Barcelona.
Associate Prof. at WashU School of Medicine; biophysics/biochem/evolution of intrinsically disordered proteins. How does nature encode function without a stable structure? We work in vivo / in vitro / in silico. He/him.
https://www.holehouselab.com/
Biophysics; protein dynamics/folding using smFRET and HDX-MS.
https://jhsmit.org/
International Conference on Learning Representations https://iclr.cc/
PhD student @MIT • Research on Generative Models for Biophysics and Drug Discovery
Computational Structural Biology @biozentrum.unibas.ch @unibas.ch @sib.swiss | President of the Research Council of the @snsf-ch.bsky.social | Team Science 🧪
Acta Crystallographica Section F: Structural Biology Communications is a structural biology communications journal published by the IUCr. http://journals.iucr.org/f
Acta Crystallographica Section D: Structural Biology is a leading structural biology journal published by the IUCr. journals.iucr.org/d
Scientist, 2017 Chemistry Nobel Prize (math and computational methods underlying cryo-EM of biological molecules), fiction writer, photographer, gardener.
Climate change, science education, fight of fascism
franxfiction.com and joachimfranklab.org
Developing macromolecular structure resources and tools for life science.
- Founding partner of the wwPDB.
- Manage the community-led PDBe-KB resource and the AlphaFold Protein Structure Database, a collaboration with Google DeepMind.
- Part of EMBL-EBI
🧬 senior postdoc with Endicott & Noble Lab [ https://t.ly/iinwc & https://t.ly/AAaA7 ]
💊 structure-based & computational drug discovery
💎 crystals, protein science
🏳️🌈 geek & mammy shark
📍Cancer Research Horizons Newcastle
📍Newcastle University
📣 Views mine
