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  1. gabedit gabedit Public

    Gabedit is a free graphical user interface for computational chemistry packages. Computational chemistry packages supported by Gabedit : Gamess-US, Gaussian, Molcas, Molpro, MPQC, NWChem, OpenMopac…

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    This repository provides a modified version of the original n2p2 software : ready-to-use software for high-dimensional neural network potentials in computational physics and chemistry.

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    CChemI is an interface to ab initio computational chemistry programs (CCP) designed for add to CCP many functionalities non available in these packages.

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