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@dftd4 @grimme-lab

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@tad-mctc
PyTorch Autodiff Implementations by @grimme-lab tad-mctc
Collection of fully differentiable versions of projects from the Grimme group

Germany

@jjgoings
Joshua Goings jjgoings
Winner of 7 J.D. Power Awards

@ionq Seattle, WA

@dftbplus
DFTB+ developers group dftbplus
Various projects related to the DFTB+ software package
@gms-bbg
GAMESS Development gms-bbg
The General Atomic and Molecular Electronic Structure System (GAMESS) is a general ab initio quantum chemistry package.

Ames, IA

@MobleyLab
Mobley Lab at UC Irvine MobleyLab
Binding free energies, molecular interactions, solvation thermodynamics, and statistical mechanics of biomolecules

University of California, Irvine

@MtoLStoN
Marcel Stahn MtoLStoN

OpenEye - Cadence Molecular Science Bonn

@pmocz
Philip Mocz pmocz
Computational Physicist and Software Engineer

Flatiron Institute New York, NY

@haneug
Hagen Neugebauer haneug
Theoretical chemist, programming in Fortran, C++, and Python

@grimme-lab Bonn, Germany

@JuliDi
Julian JuliDi
Bringing Rust to embedded systems @Systemscape.

Systemscape GmbH Germany

@marcelmbn
Marcel Mueller marcelmbn
Computational chemist in the @grimme-lab working on SQM and DFT method development.

@grimme-lab Bonn

@cplett
Christoph Plett cplett
Theoretical chemist. Developing general workflows and solvation methods in Fortran and sporadically in Python.

@grimme-lab Bonn, Germany

@thfroitzheim
Thomas Froitzheim thfroitzheim
PhD Student Theoretical Chemistry in the @grimme-lab

University of Bonn

@marvinfriede
Marvin Friede marvinfriede
Theoretical Chemist (M.Sc.)

@grimme-lab Germany

@awvwgk
Sebastian Ehlert awvwgk
Theoretical chemist, computational chemistry researcher, developing quantum chemistry in Fortran, Python and C++, packaging scientific software.

Microsoft Research, AI for Science Amsterdam, Netherlands

@drmewes
Jan-Michael Mewes drmewes
Computational Chemist with pragmatic development skills

Bonn University Bonn

@grimme-lab
Grimme lab grimme-lab
Quantum chemistry software - Made in Bonn.

University of Bonn