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Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package
Published on: September 17, 2021
Peter Jurica1, Cees van Leeuwen
1Perceptual Dynamics Laboratory, RIKEN Brain Science Institute, Wako-Shi Saitama, Japan.
This study introduces the Open-source MATLAB-to-Python Compiler (OMPC), a tool enabling transparent import of MATLAB functions into Python. OMPC facilitates a transition to open-source scientific computing, enhancing accessibility and collaboration.
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