JOSS Papers: Chemistry

All Papers
1661
 Published Papers
1467
 Active Papers
194
published Published about 2 months ago

funsies: A minimalist, distributed and dynamic workflow engine

Python Mako
@clavigne
10.21105/joss.03274
published Published 3 months ago

NoisySignalIntegration.jl: A Julia package for uncertainty evaluation of numeric integrals

Julia
@nluetts
10.21105/joss.03526
published Published 5 months ago

INCHEM-Py: An open source Python box model for indoor air chemistry

Python
@DrDaveShaw
10.21105/joss.03224
published Published 8 months ago

kallisto: A command-line interface to simplify computational modelling and the generation of atomic features

Python
@f3rmion
10.21105/joss.03050
published Published 8 months ago

libecpint: A C++ library for the efficient evaluation of integrals over effective core potentials

C++ Visual Basic Python
@robashaw
10.21105/joss.03039
published Published 9 months ago

IFermi: A python library for Fermi surface generation and analysis

Python
@utf
10.21105/joss.03089
published Published 9 months ago

polypy - Analysis Tools for Solid State Molecular Dynamics and Monte Carlo Trajectories

Python
@symmy596
10.21105/joss.02824
published Published over 1 year ago

Chemiscope: interactive structure-property explorer for materials and molecules

JavaScript TypeScript
@luthaf
10.21105/joss.02117
published Published over 1 year ago

PyCHAM: CHemistry with Aerosol Microphysics in Python

Python
@simonom
10.21105/joss.01918
published Published over 1 year ago

pygen-structures: A Python package to generate 3D molecular structures for simulations using the CHARMM forcefield

Python
@thesketh
10.21105/joss.02157
Displaying papers 1 - 10 of 22 in total

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ISSN 2475-9066