Computational Chemistry & Molecular Interactions Lab
Paulo J. Costa Lab @ BioISI. We use computational chemistry techniques to understand (bio)molecular recognition phenomena and attempt to offer a quantitative analysis of binding contributions.
@guilhermegmoreira.bsky.social
@jacs.acspublications.org
Research, news, and information from the Journal of the American Chemical Society: pubs.acs.org/JACS
@claudiogomeslab.bsky.social
Studying proteins and molecular mechanisms of misfolding and aggregation in Alzheimer's Disease and protein folding disorders at ULisboa | Tau | Amyloid | Chaperones | Proteostasis | Structural Biochemistry | https://folding.campus.ciencias.ulisboa.pt
@poruthoor.bsky.social
Postdoc @ Alex MacKerell Lab Former member of Grossfield Lab Interested in Membrane Permeability, Phase separation, and Computer Aided Drug Discovery. Currently working with Permeability predictions and Endocannabinoid signaling players
@chemicalscience.rsc.org
Flagship journal for @rsc.org, open access with no publication fee, all topics in chemistry. chemicalscience-rsc@rsc.org Celebrating our 15th year in 2025! 🌐 Website: rsc.li/chemscience
@estherjohnston.bsky.social
Scientific Editor of @chemicalscience.rsc.org, the flagship journal of the Royal Society of Chemistry. Diamond open access! | bioinorganic chemist | PhD Stanford University, post-doc University of York | wife, mum, gardener, Christian | she/her
@biophysj.bsky.social
The premier journal of quantitative biology and leading journal for molecular, cellular, and systems biophysics research. Editor-in-Chief: Vasanthi Jayaraman.
@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/
@plos.org
PLOS is a non-profit organization on a mission to drive open science forward with measurable, meaningful change in research publishing, policy and practice.
@natcomms.nature.com
Nature Communications is an open access journal publishing high-quality research in all areas of the biological, physical, chemical, clinical, social, and Earth sciences. www.nature.com/ncomms/
@natrevdrugdiscov.nature.com
Editorial team of Nature Reviews Drug Discovery www.nature.com/nrd
@science.org
The world's leading outlet for cutting-edge research in all areas of science. https://www.science.org
@madsgirao.bsky.social
Bioinformatics & Computational Biology MSc • Cell Biology & Biotechnology BSc • Freelance English Instructor • PT & EN • she/her • Ideas and opinions are my own!
@hiddencosmo.bsky.social
physics, sci-comm, education | active matter, MSc @cienciasulisboa | 🇵🇹 linkedin.com/in/acrribeiro/
@js-figueiredo.bsky.social
Computational chemist @ CICECO. Former dweller of the experimental-computational limbo.
@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
@vwscc.bsky.social
🧪💻 The Virtual Winter School on Computational Chemistry (VWSCC) is a global online event featuring expert lectures, workshops, panels, and research presentations. Perfect for learning & sharing in computational chemistry! --- https://winterschool.cc/
@mrclmllr.bsky.social
Computational chemist in the @grimmelab.bsky.social @ @unibonn.bsky.social working on QM developments and novel digital solutions. Before w/ @MerckGroup.
@mhko.bsky.social
Biophysicist based in Prague, CZE. Interested in ribosomes, conformational disorder, and computation. Volunteer in @czexpats.bsky.social, Editorial Board Member of @commsbio.bsky.social. Likes traveling by train, dislikes tomatoes. https://kolar.vscht.cz
@silviaescayola.bsky.social
Computational Chemist👩🏻💻 | Postdoc @humboldt-foundation.de at @unistuttgart.bsky.social | PhD @dimocat-iqcc.bsky.social @iqccudg.bsky.social and @DIPCehu
@pubpeer.com
PubPeer is a platform for post-publication peer review, offering an additional layer of evaluation beyond journal names. Empowering the scientific community to assess science and scientists transparently. pubpeer.com
@franknoe.bsky.social
Scientist, #MachineLearning and #AI for Moleculear Sciences. Scuba Diver. Loves @cecclementi.bsky.social
@jpoverington.bsky.social
Work at drughunter.com - Drug Discovery, Data Science, Cheminformatics, Computational Medicinal Chemistry, Drug Repositioning, Structural Bioinformatics, CADD, SaaS, DaaS, AI/ML https://scholar.google.com/citations?user=52VMFeYAAAAJ
@jpglmrodrigues.bsky.social
Computational Biologist and Team Lead at Schrodinger. Proteins & Python. Opinions are my own. https://joaor.eu
@eicc2025.bsky.social
7th EuChemS Inorganic Chemistry Conference September 7-11, 2025 Belgrade, Serbia Faculty of Chemistry- University of Belgrade Website: https://eicc7.com/
@cienciasulisboa.bsky.social
Vem fazer parte da nossa História construindo o teu Futuro! Faculdade de Ciências da Universidade de Lisboa.
@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
@natesjacobs.bsky.social
surfer, dad, (former) neuroscientist, research technologist, entrepreneur, open science advocate, sometimes writer.
@bravo-abad.bsky.social
Professor of Physics at UAM | Profesor Titular. PI of the AI for Materials Lab | Director del Laboratorio de IA para Materiales. https://bravoabad.substack.com/
@dmitri-kireev.bsky.social
Professor of Chemistry at the University of Missouri - Columbia. #France #USA #Ukraine Fun stuff: #DrugDiscovery #MachineLearning #VirtualScreening #CompChem More fun stuff: #music #running #photography
@bussilab.org
Research group lead by @bussigio.bsky.social at SISSA | #RNA, #moleculardynamics, and more | web: http://bussilab.org
@rsc.org
With the future of the world in the balance, everyone has a role to play in making it better. How will you join in? 🌐 Website: www.rsc.org
@quantumalicante.bsky.social
**Quantum & Computational Chemistry #compchem #theochem #DFT 💻🌍💭 **Scientist and Senior Lecturer at University of #Alicante, Spain. 🇪🇸☀️🥘🍤🍊⛵️⛱️ **Editor-in-Chief of Theor. Chem. Acc. (founded in 1962, the oldest journal in our field) Views are my own
@row1.ca
I talk about computational #openscience communication and science publishing. On the jupyterbook.org & @mystmd.org teams, co-founder of @curvenote.com.
@catalysis-lab.bsky.social
Catalysis, electrochemistry, C−H activation, peptides, computation, late-stage diversification. Based @UGOE Account managed by group members
@trujillo-group.bsky.social
Computational Organic Chemist @University of Manchester #CompChem 💻 ⚛️ #Catalysis 🇪🇸 → 🇬🇧 | Mum of 3 boys 🤩 Cyclist 🚴♀️ | Yogi 🧘♀️ | Amateur cook Rock music fan 🎸 🔗 https://trujilloresearchgroup.com/
@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🤔
@santiagomovilla.bsky.social
Molecular Modeler #compchem from Colombia #cienciacriolla. #PhD in Theoretical Chemistry and Molecular Modelling. Postdoc Researcher at Orozco's Lab at @irbbarcelona.org 🧬🖥️
@irbbarcelona.org
International research centre devoted to curing #cancer and other diseases linked to #aging. @cerca.cat center, member of @bist.eu. www.irbbarcelona.org
@ccdc.cam.ac.uk
The CCDC is a non-profit, charitable institution focused on the advancement & promotion of chemistry & crystallography. Website: https://www.ccdc.cam.ac.uk/
@adrianmulholla1.bsky.social
Professor of Chemistry, University of Bristol. Computational chemistry,enzyme catalysis, biomolecular simulation,HPC,antibiotic resistance.Views my own.
@pdbeurope.bsky.social
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