JOSS Papers: reviewed by @naik-aakash

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published Published about 1 month ago

PyDMF: A Python package for variational double-ended reaction-path and transition-state optimization

Python
@shin1koda
10.21105/joss.10379
published Published over 1 year ago

SPARC-X-API: Versatile Python Interface for Real-space Density Functional Theory Calculations

Python
@alchem0x2a
10.21105/joss.07747
published Published almost 2 years ago

MoSDeF-dihedral-fit: A lightweight software for fitting dihedrals within MoSDeF

Python
@jpotoff
10.21105/joss.06970
published Published over 2 years ago

calorine: A Python package for constructing and sampling neuroevolution potential models

Python C++ Jupyter Notebook
@elindgren
10.21105/joss.06264
Displaying 4 papers

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ISSN 2475-9066