Lily Wang
Science lead at Open Force Field. Core developer at MDAnalysis. Has never met an opossum.
@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
@jordanlshivers.bsky.social
Schmidt AI in Science Postdoctoral Fellow at U. Chicago soft matter, biophysics, machine learning jordanshivers.github.io
@nanoporous.net
Senior researcher @CNRS, computational chemist. Professor @ENS_ULM @PSL_Univ. First responder & instructor @CroixRouge.
@molly.wiki
independent writer of citationneeded.news and @web3isgoinggreat.com • tech researcher and cryptocurrency industry critic • software engineer • wikipedian support my work: citationneeded.news/signup links: mollywhite.net/linktree
@yoshanuikabundi.me
Comp chem, chemical biology, software development and science communication at Open Force Field @openforcefield.org @omsf.io She/they/he 🩷💛🩵 🏳️🌈
@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
@westpasoftware.bsky.social
https://westpa.github.io Open-source, highly scalable software for running weighted ensemble simulations with any dynamics engine, including MD (e.g., Amber, OpenMM) and systems biology engines (BioNetGen). We are part of the @omsf.bsky.social consortium.
@openmm.org
A high-performance toolkit for molecular simulation. Visit us at https://openmm.org/ and https://github.com/openmm.
@finlayclark.bsky.social
Comp chem PhD student at the University of Edinburgh interested in binding free energy calculations.
@jthorton22.bsky.social
@dwhswenson.net
@mandalgroup.bsky.social
Studying Light-Matter Interactions at Texas A&M Theoretical Chemistry, Light-Matter Interactions, Quantum Dynamics https://mandalgrouptamu.com #compchem #chemsky #theochem
@giuliapalermo.bsky.social
https://palermolab.com Giulia Palermo Lab at the University of California, Riverside. Biophysicist passionate about Science & Art! In love with Nucleic Acids and Computational Science!
@mariak630.bsky.social
Professor, Carnegie Mellon University; computational biophysicist and theoretical chemist
@titouloos.bsky.social
CNRS senior research at the Laboratoire de Chimie et Physique Quantiques in Toulouse (France) interested in electronic structure theory & excited states
@rjai.me
Another PhD captured by open source. ⇒ Core team at @conda-forge.org. ⇒ Steering council at @conda.org. ⇒ Staff Software Engineer at @quansight.com. ⇒ Blogging at rjai.me.
@kristianfrandsen.bsky.social
Researcher at Technical University of Denmark (DTU), Dept. Bioengineering Enzyme Discovery group | former University of Copenhagen Section for Glycobiology and France's National Research Institute for Agriculture, Food and Environment in Marseille #INRAE
@liweichang.bsky.social
Interested in molecules, small and large, exploring the diversity of nature.
@piquemalgroup.bsky.social
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
@drenerbas.bsky.social
Maths, molecules, finance, ML. An Australian in a Silicon Valley.
@corminboeuf-lab.bsky.social
Head of the Computational Molecular Design Laboratory at @EPFL-chem. Mom of two girls. #comp
@drgregbowman.bsky.social
Scientist. Christ-follower. Prof @UPenn. Director of Folding@home. Legaly blind. Father.
@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
@andrewrosen.bsky.social
Assistant Professor at Princeton. Quantum-chemical engineer and materials designer. https://rosen.cbe.princeton.edu
@aspuru.bsky.social
Professor of Chemistry and Computer Science University of Toronto Faculty member, Vector Institute Director, Acceleration Consortium My views expressed here are personal and are not those of my employers.
@adrianmulholla1.bsky.social
Professor of Chemistry, University of Bristol. Computational chemistry,enzyme catalysis, biomolecular simulation,HPC,antibiotic resistance.Views my own.
@jjguven.bsky.social
PhD student in the Mey group, working on alchemical methods for metalloproteins. Love public engagement & teaching https://jasmin-guven.github.io Pronouns: She/her All views are my own.
@bonomimax.bsky.social
Head of Computational Structural Biology Lab @pasteur.fr. ERC-CoG 2022. Research Director DR2 @cnrs.bsky.social. Founder/developer @plumed.org
@cdg-gpcr.bsky.social
Head of Computational Drug Discovery and Data Science at Structure Therapeutics | GPCR | SBDD | CADD | Cheminformatics | Computational Chemistry | Medicinal Chemistry | Drug Design
@creechem.bsky.social
Postdoc @ Daniel Cole group, Newcastle University. Computational Chemistry.
@labcosmo.bsky.social
Computational Science and Modelling of materials and molecules at the atomic-scale, with machine learning.
@micheleceriotti.bsky.social
Italian in Switzerland, @lab_COSMO PI. Husband of one, father of three. Increasing the entropy of the universe since 1982.
@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..?
@proteinmagnus.bsky.social
Protein biophysicist working on intrinsically disordered proteins in neuroscience and biotech. Assoc. prof at @MolBiolAU and @PromemoAU. (He/Him)
@rohitpappu68.bsky.social
Biophysics, soft matter physics, intrinsically disordered proteins, macromolecular interactions, & phase transitions are my interests. Discovery through rigor and collaboration is my passion. Kindness, generosity, humility, and justice are my hopes.
@albertvilella.bsky.social
Bioinformatics Scientist / Next Generation Sequencing, Single Cell and Spatial Biology, Next Generation Proteomics, Liquid Biopsy, SynBio, Compute Acceleration in biotech // http://albertvilella.substack.com
@asmaferiel.bsky.social
PhD @ColeGroupNCL.bsky.social Drug Design EPSRC-MoSMed CDT + collab @openSciSaudi + Artist alum: @mcgillu @UMontreal 🇯🇴 🇩🇿 🇸🇦 🇨🇦 🇬🇧 website 👉 asmaferiel000.github.io/AsmaFeriel.git…
@howardfmaclean.bsky.social
Convenor of @greatercanberra.org.au- Lawyer, general purpose nerd. Building better cities requires actually building. Views my own.
@avogadro.cc
Advanced molecule editor and visualizer Currently working towards Avogadro2 https://two.avogadro.cc/ https://discuss.avogadro.cc/
@mikefeigin.bsky.social
Associate Professor at Roswell Park Comprehensive Cancer Center. GPCRs and gene regulation in pancreatic cancer. Posts are mine.
@markusdeserno.bsky.social
Theoretical and computational biophysicist at Carnegie Mellon University. Loves lipid membranes, music, and art. (he/him) 🇩🇪🇺🇸
@mcs07.bsky.social
Software and cheminformatics for drug discovery. Working at D. E. Shaw Research.
@lakkaraju.bsky.social
Part time news junkie, full time computational scientist. Interested in how molecular simulations, AI and everything in between drives drug discovery.