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.
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Updated
Apr 7, 2022 - Python
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
Visual Simulation of Molecular Dynamics using the Cairo library
A repository for my applied math investigations into various interdisciplinary topics
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.
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
Calculate error propagation (CHEM 373)
Display things like DeltaG with an actual Delta symbol in SymPy equations in Jupyter notebooks
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