-
National Institute of Standards and Technology
- Gaithersburg, USA
- amru@seas.upenn.edu
- @AmruTheFirst
Highlights
- Pro
-
mdanalysis Public
Forked from MDAnalysis/mdanalysisMDAnalysis is a Python library to analyze molecular dynamics simulations.
Python Other UpdatedFeb 19, 2025 -
-
gromacs Public
Forked from gromacs/gromacsPublic/backup repository of the GROMACS molecular simulation toolkit. Please do not mine the metadata blindly; we use https://gitlab.com/gromacs/gromacs for code review and issue tracking.
C++ GNU Lesser General Public License v2.1 UpdatedAug 30, 2024 -
lammps Public
Forked from lammps/lammpsPublic development project of the LAMMPS MD software package
C++ GNU General Public License v2.0 UpdatedAug 22, 2024 -
freud Public
Forked from glotzerlab/freudPowerful, efficient particle trajectory analysis in scientific Python.
C++ BSD 3-Clause "New" or "Revised" License UpdatedAug 1, 2024 -
-
polydisperse-md Public
Forked from mandadapu-group/polydisperse-mdA plug-in for HOOMD-Blue, a particle simulation toolkit, that implements soft continuous-polydisperse particles for molecular dynamics on the CPUs and GPUs.
C++ BSD 3-Clause "New" or "Revised" License UpdatedJul 15, 2022 -
fractal_analysis Public
Fractal analysis of high dimensional points using various methods
Python UpdatedJul 14, 2022 -
hoomd-blue Public
Forked from glotzerlab/hoomd-blueMolecular dynamics and Monte Carlo soft matter simulation on GPUs.
C++ BSD 3-Clause "New" or "Revised" License UpdatedJun 22, 2022 -
lab_site Public
Forked from rar-ensemble/lab_siteJekyll source code to generate Rob Riggleman's research lab website
HTML UpdatedApr 19, 2021 -
create_jobs Public
Forked from benlindsay/create_jobsTool to facilitate the creation of compute jobs with different parameters
Python MIT License UpdatedMar 3, 2021 -
pylevy Public
Forked from josemiotto/pylevyLevy distributions for Python
Python GNU General Public License v3.0 UpdatedJan 21, 2021 -
Wales-pele Public
Forked from pele-python/peleWales' Python energy landscape explorer
Python Other UpdatedApr 30, 2019 -
Examples Public
Forked from smcantab/ExamplesMany examples of many features of many software packages
C++ UpdatedSep 19, 2014