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@WardLT
Logan Ward WardLT
- Computational Materials Scientist - AI Researcher and Educator - Boardgame Enthusiast

NVIDIA Atlanta, GA

@HassanHarb92
Hassan Harb HassanHarb92
Postdoctoral Researcher - Argonne National Lab

Argonne National Lab Lemont, IL

@naromero77amd
Nichols A. Romero naromero77amd
Ex-Argonne, Ex-Intel, Ex-Samsung. Currently working on AMD PyTorch Team focusing on community issues.

AMD Naperville, IL

@HUBioDataLab
Hacettepe University Biological Data Science Laboratory HUBioDataLab
An academic research laboratory focusing on machine/deep learning applications in the fields of bioinformatics and cheminformatics

Turkey

@mkite-group
mkite mkite-group
Distributed computing for high-throughput materials simulation
@pedroantoniosantosf
Pedro Antonio Santos Florez pedroantoniosantosf

University of North Carolina at Charlotte Charlotte, NC - USA

@NWChemEx
NWChemEx Community NWChemEx
Dedicated to developing high-performance, modular, scientific software by leveraging NWChemEx's infrastructure.

United States of America

@josejimenezluna
José Jiménez-Luna josejimenezluna
Driving drug discovery one gradient update at a time.

@MicrosoftResearch Cambridge, UK

@ChrisTitusTech
Chris Titus ChrisTitusTech
Tech Content Creator

CT Tech Group LLC Dallas, TX

@cryptomator
Cryptomator cryptomator
Encrypt your cloud, protect your privacy • Made by @skymatic

Germany

@Argonne-National-Laboratory
Argonne National Laboratory Argonne-National-Laboratory
This is not a complete list of all ANL OSS code

Argonne, IL

@simongravelle
Simon Gravelle simongravelle
CNRS researcher in LIPhy, Grenoble, France

LIPhy Grenoble, France

@phanish-suryanarayana
Phanish Suryanarayana phanish-suryanarayana
Professor at Georgia Institute of Technology. PhD from California Institute of Technology in 2011.

Georgia Institute of Technology Atlanta, GA, USA

@mnicely
Matthew Nicely mnicely
DL Compiler Product Manager mnicely@nvidia.com

NVIDIA Huntsville, AL

@npaulson
Noah Paulson npaulson

Argonne National Laboratory

@hfp
Hans Pabst hfp
HPC and Scientific Computing

Intel Extreme Computing Software and Systems Zurich / Switzerland

@Leticia-maria
Leticia Madureira Leticia-maria
Computational Quantum Chemist. Developing QC packages in Julia. PhD student at Carnegie Mellon University.

@JuliaChemicalReactions, @HartreeFoca Pittsburgh, Pennsylvania, US

@AspirinCode
Jianmin Wang AspirinCode
Drug Design , Linux enthusiast , Medicinal_Chemistry_&_ Synthesis , Chemoinformatics , Data Science, Python and C/C++ programmer,Bioinformatics,Deep Learning,AI

Yonsei University 中国(China)

@dilkins
David M Wilkins dilkins

School of Mathematics and Physics, Queen's University Belfast

@muammar
Muammar El Khatib muammar
I am a PhD in Theoretical Physical Chemistry who also likes coding.

Greater Boston, Massachusetts

@Conkeryome
Oscar Márquez Conkeryome
A Data Science and AI enthusiast becoming coffee into code.

IAM-TZITÉ CDMX, México

@colleeneb
Colleen Bertoni colleeneb

Argonne National Laboratory

@juanchuletas
Juan José García juanchuletas
C++ developer

Mexico City

@gabegomes
Gabe Gomes gabegomes
Assistant Professor at Carnegie Mellon University with the @gomesgroup | Departments of {Chemistry, Chemical Engineering, Machine Learning}

@gomesgroup Pittsburgh, PA

@shankar1729
Ravishankar Sundararaman shankar1729
Lead developer of JDFTx, open-source software for joint density functional theory. Associate Professor in Materials Science and Engineering at RPI.

Rensselaer Polytechnic Institute Troy, NY

@angeloziletti
Angelo Ziletti angeloziletti
A data & machine learning scientist that loves to creatively solve complex problems via deep learning, unsupervised learning, and natural language processing

@bayer-science-for-a-better-life Berlin, Germany

@BingqingCheng
Bingqing Cheng BingqingCheng
I'm a computational material scientist, who is trying to make all the input files and data analysis notebooks of all my projects publicly available.
@iwatobipen
Taka iwatobipen
I'm Medicinal Chemist a/o Chemoinformatitian in mid. size pharmaceutical company in Japan. My hobby is programming, running and Volleyball.

Daiichi-Sankyo

@jramapuram
Jason Ramapuram jramapuram
Making machines learn, one sample at a time.
@llSourcell
Siraj Raval llSourcell
Senior AI/ML Engineer | Specializing in production-ready, trustworthy AI systems (GenAI, RAG, CV, MLOps).
@keceli
Murat Keçeli keceli

Argonne National Laboratory

@jameskermode
James Kermode jameskermode

University of Warwick Coventry, UK

@ceriottm
Michele Ceriotti ceriottm

EPFL Lausanne - Switzerland