A GUI to predict and draw molecular shapes using VSEPR theory (Class XI AISSCE Project)

Physics-first molecular simulation engine built in C++ with interpretable force-field mechanics and deterministic optimization.

C++ force simulator program for atoms in a 3-D system.

A simple program where you input a covalent compound and it outputs information about it.

This project started a few weeks ago when I had the idea of applying my knowledge from chemistry class in order to create a website that would allow users to enter a compound, and then it would give relevant information such as the structural formula, bond orders, central atom and much more.

A lightweight, high-performance molecular geometry optimizer based on VSEPR theory and spatial hashing, written in Rust.