Generate input parameters and coordinates for atomistic and coarse-grained simulations of polymers, ssDNA, and carbohydrates
Ordinal Solvation Framework (OSF) for predicting polymer–solvent solvation behaviour using multi-resolution ordinal modelling and continuous interaction coordinates.
Controller for a Legato 100 syringe pump, commonly used in flow chemistry experiments
A Python library for thermal analysis and reaction kinetics. Supports DSC, TGA, and dilatometry with tools for model-fitting (JMAK, Kissinger), model-free (Friedman, KAS, OFW) analysis, data processing, and visualization.
Multimodal Machine Learning for Soft High-k, Low-Modulus Polymers under Data Scarcity
Software for Polymerization and Reaction Kinetics Simulations
The Python package for the uFJC single-chain model.
This repository contains the code files of the Chemical engineering Summer Project
Color targeting with Modular Electrochromic Polyesters -- by John M. Toribio, Ph.D.
Polymer-Oriented Library Yielding Structure Assignment, Calculation of CHARges, Interchange, and Data Elucidation
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