Passionate about modelling, I Love using and programming computational tools to tackle scientific and business challenges.
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StatMech
StatMech PublicList of projects for Statistical Mechanics: Algorithms and Computations Coursera course (but in Fortran)
Fortran
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nwchem
nwchem PublicForked from nwchemgit/nwchem
NWChem: Open Source High-Performance Computational Chemistry
Fortran
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deepchem
deepchem PublicForked from deepchem/deepchem
Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology
Python
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openbabel
openbabel PublicForked from openbabel/openbabel
Open Babel is a chemical toolbox designed to speak the many languages of chemical data.
C++
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