There are 0 repository under polymers topic.
Generate input parameters and coordinates for atomistic and coarse-grained simulations of polymers, ssDNA, and carbohydrates
Condensed-phase polymer degradation CHEMKIN format kinetic mechanisms.
Controller for a Legato 100 syringe pump, commonly used in flow chemistry experiments
Influence of charge regulation on conformational ,ionization properties and dynamics of polyelectrolytes
Papers reading roadmap for anyone whose research in the area of polymer simulations!
Trajectory matching and Bayesian parametrisation to construct coarse-grained force field for polymer systems
The Python package for the uFJC single-chain model.
Python package to analyze molecular simulation data generated using GROMACS-INDUS.
Fortran code applying the finite element method to run three-dimensional calculations based on self-consistent field theory.
Core scripts for FluoroMatch, LipidMatch, and PolyMatch
Polymer-Oriented Library Yielding Structure Assignment, Calculation of CHARges, Interchange, and Data Elucidation
My project for the Science Undergraduate Laboratory Internship program at Argonne National Laboratory
Fortran code applying the finite differences method to run one-dimensional calculations based on self-consistent field theory
Rayleigh Sommerfeld Backpropagation Implementation for Colloids
📃 Reading research papers 📃
The project focused on predicting polymer composite thermal conductivity using SVR algorithm, PSO optimization, and LOOCV.
Package for computing secondary nucleation constants from DSC measurements Enthalpy vs time
Surface nucleation module to fit enthalpy - time measurements