RadonPy / RadonPy Star 125 Code Issues Pull requests RadonPy is a Python library to automate physical property calculations for polymer informatics. data-science polymer simulation modeling molecular-dynamics molecular-dynamics-simulation lammps rdkit materials-science materials-informatics data-driven-design polymer-simulation high-throughput-computing psi4 polymer-informatics Updated Dec 26, 2023 Python
RobJMal / Polymer-Dynamics-Simulation-PS10 Star 1 Code Issues Pull requests Final project for PS10 course. Simulates the motion of polymers using an freely-jointed chain model in 1D, 2D, and 3D. chemistry thermodynamics polymer-simulation harvard-ps10 Updated Dec 14, 2020 MATLAB
rangsimanketkaew / topology_violation Star 0 Code Issues Pull requests Determine the topology violation in coarse-grained polymer simulation. python polymer molecular-dynamics lammps multiscale-simulation topology-violation polymer-simulation dpd-simulation tv-count Updated Jan 1, 2022 Python
wpwonglab / Brownian-Dynamics-Simulation Star 0 Code Issues Pull requests polymer-simulation brownian-dynamics vonwilllebrand Updated May 10, 2023 Fortran
Victor515 / MC-simulation-BPTHF Star 0 Code Issues Pull requests A Polymer Monte Carlo Simulation Program monte-carlo monte-carlo-simulation polymer-simulation Updated Sep 12, 2017 MATLAB