This package intends to generate a quantitative metric in how similar IR plots of carbohydrate conformers. In addition, there are graphical functionalities to display molecular data.

Stochastic chemical kinetics using Gillespie algorithm and chemical master equation, application to enzyme kinetics

This is a software to help food scientists in their everyday lab work making easy to calculate physical chemical parameters in a range of food sources

Plots for reversible first order reactions

Computational implementation of Brusselator, a theoretical model for a type of autocatalytic reaction.

Personal blog.

A Simple Algorithm for Converting Random Number Generator Outputs to Universal Distributions to Aid Teaching and Research in Modern Physical Chemistry

my thesis code for NNP

physical chemistry 3 class supplementary information

A repository for my applied math investigations into various interdisciplinary topics

fast and easy development of simulation methods and teaching purposes

Code to calculate the vapor-liquid interface in ionic fluids using modified Gaussian renormalized fluctuation theory

A simple script to plot volume X temperature X pressure for ideal gases

Welcome to the Lab! Let's Advance the chemical sciences with molecular simulations. 🧪

Visualize TCSPC data with PGFPlots & TikZ.

The Book about Physical Body

Calculate error propagation (CHEM 373)

Calculate oxygen solubility in water at any temperature between 0°C - 50°C based on published empirical model (Hitchman, Measurement of Dissolved Oxygen, 1978), and tabulated vapour pressures of water.

Display things like DeltaG with an actual Delta symbol in SymPy equations in Jupyter notebooks