masrul

I did my Ph.D. from Mississippi State University with a major in Chemical Engineering and a minor in CSE.

Pinned Repositories

DSMC
Direct Simulation Monte Carlo for rarified gas
Language:Fortran6 2 02
GenTopo
Gromacs topology template generator
Language:Python14 2 11
GMXFit
PES Fitting for gromacs
Language:Python3 2 00
GMXTraj
Gromacs trajectory reader with OOP style for C++
Language:C5 1 00
Inception
Blazingly fast molecular packing
Language:C++10
MolAligner
Play with molecular structures
Language:Python2 1 10
MonteCarlo-Pi
Language:Python2 2 00
PES_NN
Language:Python1 2 00
quickPDF
Language:Python1 2 00
vmath
Numpy like operation on C++ vector
Language:C++1 1 00

masrul's Repositories

masrul/GenTopo
Gromacs topology template generator
Language:Python14 2 11
masrul/GMXTraj
Gromacs trajectory reader with OOP style for C++
Language:C5 1 00
masrul/MolAligner
Play with molecular structures
Language:Python2 1 10
masrul/MonteCarlo-Pi
Language:Python2 2 00
masrul/Inception
Blazingly fast molecular packing
Language:C++10
masrul/PES_NN
Language:Python1 2 00
masrul/vmath
Numpy like operation on C++ vector
Language:C++1 1 00
masrul/BibtexFixer
Remove duplicates from bibtex
Language:Python0 2 00
masrul/AutoDock-Vina
AutoDock Vina
Language:C++0 0
masrul/Cassandra
Cassandra is a Monte Carlo package to conduct atomistic simulations.
Language:Fortran0 0
masrul/DataStructures-and-Algorithms
Data structures and algorithms using C++
Language:C++
masrul/FixPBC
Fix PBC of macromolecules
Language:C++
masrul/foyer
A package for atom-typing as well as applying and disseminating forcefields
Language:Python0 0
masrul/Grokking-the-Coding-Interview-Patterns-for-Coding-Questions
masrul/helpme
helPME: an efficient library for particle mesh Ewald
Language:C++0 0
masrul/House-And-Senate-Stock-Transactions
How to get the US Senate and House of Representatives Stock Transactions
Language:R0 0
masrul/iCoMSE-DFT-Catalysis-School
Collection of Tutorials and Lectures from the DFT Catalysis School hosted at Mississippi State University, June 2022
Language:Vim Script0 0
masrul/indicators
Activity Indicators for Modern C++
masrul/jekyll-base
Language:SCSS1 0
masrul/masrul
2 0
masrul/masrul.github.io
Masrul's Protfolio
1 0
masrul/modern-cpp-features
A cheatsheet of modern C++ language and library features.
Language:Python0 0
masrul/molcloud
Make a bunch of molecules
masrul/MolecularCluster
Find number of molecular cluster
Language:C++
masrul/pugixml
Light-weight, simple and fast XML parser for C++ with XPath support
Language:C++0 0
masrul/RandomViz
Language:Python2 0
masrul/selfies
Robust representation of semantically constrained graphs, in particular for molecules in chemistry
Language:Python1 0
masrul/Test
1 0
masrul/tomlplusplus
Header-only TOML config file parser and serializer for C++17.
masrul/YAPT
Language:Python1 0