Popular repositories

1. thermotar thermotar Public

   For importing and generating some LAMMPS and GROMACS files types, with a light bit of analysing too

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2. lammps lammps Public

   Forked from lammps/lammps

   Public development project of the LAMMPS MD software package

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3. dummify dummify Public

   This package adds virutual massless atoms. Currently aimed at tip4p water models, really only with TIP4P/2005 parameters as well, flexibility for other 4 body water models is getting there

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4. multipole-parakeet multipole-parakeet Public

   A MD Analysis Class for calculating the charge, dipole and quadrapole density distributions

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5. TSEOS TSEOS Public

   TwoState Equation of State for tip4p05, implementing the one by Biddle et.al. (http://arxiv.org/abs/1611.00443v5)

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6. product_index product_index Public

   Convert a cartesian product index into the N indices of the original arrays

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