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Masrul Huda's Projects

cassandra icon cassandra

Cassandra is a Monte Carlo package to conduct atomistic simulations.

dsmc icon dsmc

Direct Simulation Monte Carlo for rarified gas

foyer icon foyer

A package for atom-typing as well as applying and disseminating forcefields

gentopo icon gentopo

Gromacs topology template generator

gmxtraj icon gmxtraj

Gromacs trajectory reader with OOP style for C++

helpme icon helpme

helPME: an efficient library for particle mesh Ewald

icomse-dft-catalysis-school icon icomse-dft-catalysis-school

Collection of Tutorials and Lectures from the DFT Catalysis School hosted at Mississippi State University, June 2022

libgmxcpp icon libgmxcpp

C++ toolkit for use in reading in and analyzing Gromacs files

mdtraj icon mdtraj

An open library for the analysis of molecular dynamics trajectories

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