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Amir Hajibabaei's Projects

easy-meta-md icon easy-meta-md

symbolic collective variable definitions and automation of metadynamics

f90wrap icon f90wrap

F90 to Python interface generator with derived type support

gfort2py icon gfort2py

Library to allow calling fortran code from python

packmol icon packmol

Packmol - Initial configurations for molecular dynamics simulations

py_c_f icon py_c_f

mixed language (py/c/fortran) programming templates for high performance computing

tools-and-data icon tools-and-data

A collection of tools and databases for atomistic machine learning

universe2d icon universe2d

a fortran object for moving particles around in a 2d box

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