Modeling, Design and Optimization of Mineral Processing Systems

⛰️ PrexSyn: Efficient and Programmable Exploration of Synthesizable Chemical Space

Torch-native, batchable, atomistic simulations.

Flow Matching for Electron Redistribution

Companion webpage for the book "Bayesian Optimization" by Roman Garnett

CME-ChatGPT Material Explorer

Repository of POMDP problems in ecology, biosecurity and epidemiology

Example Repo for the Udemy Course "Deployment of Machine Learning Models"

Data Science for Geosciences @ Stanford

The POMCP algorithm implemented in Julia

Simulators for POMDPs.jl

QMDP Solvers for POMDPs

MDPs and POMDPs in Julia - An interface for defining, solving, and simulating fully and partially observable Markov decision processes on discrete and continuous spaces.

Decision making under uncertainty using the POMDPs.jl ecosystem taught by Robert Moss

Perform Model Checking and POMDP Planning from LTL specifications using POMDPs.jl

Two guest lectures for MatSE580 at PSU to cover basics of (1) materials data manipulation, (2) storage, and (3) running ML methods on them.

Two guest lectures for MatSE580 at PSU to cover basics of (1) materials data manipulation, (2) storage, and (3) running ML methods on them.

JDFTx: software for joint density functional theory

BURAI, a GUI system of Quantum ESPRESSO

Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It i…

Python Materials Discovery Framework