Pinned Repositories
autodE
automated reaction profile generation
autodE
automated reaction profile generation
gap-train
Gaussian Approximation Potential Training
md-comparison
Molecular Dynamics in a variety of languages
mol-wasm
Molecular visualisation with web assembly
opt-rs
molecular mechanics optimisation
ORCA-scripts
Python scripts for generating .inp and parsing .out
rksim
Reaction Kinetics Simulation and Fitting
soap-rust
Smooth Overlap of Atomic Positions in rust
t-young31's Repositories
t-young31/opt-rs
molecular mechanics optimisation
t-young31/soap-rust
Smooth Overlap of Atomic Positions in rust
t-young31/md-comparison
Molecular Dynamics in a variety of languages
t-young31/autodE
automated reaction profile generation
t-young31/gha-aks-prototype
t-young31/aad-opa-auth-k8s-api-prototype
t-young31/ads-api-search-and-add
t-young31/ALPS
The Arbitrary Linear Plasma Solver
t-young31/amol-opt
t-young31/autode-feedstock
A conda-smithy repository for autode.
t-young31/azure-arc-k8s
AWS K8s with rancher connected to AML
t-young31/azure-redcap
REDCap deployment on Azure
t-young31/azure-redcap-prototype
t-young31/AzureTRE
An accelerator to help organizations build Trusted Research Environments on Azure.
t-young31/AzureTRE-Deployment
t-young31/containerssh-k8s-prototype
Prototype ContainerSSH deployment
t-young31/cost-k8s-prototype
t-young31/jupyterhub-k8s-prototype
JupyterHub deployment on AWS EC2 with AAD auth
t-young31/k8s-backup-prototype
t-young31/kasmvnc-oidc-azure-prototype
t-young31/kl
Fast access to k8 pod logs
t-young31/ocost
OpenCost Frontend
t-young31/pre-commit-hooks
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t-young31/service-alerting-prototype
OpsGenie alerting prototype for a toy service
t-young31/service-workbench-on-aws
A platform that provides researchers with one-click access to collaborative workspace environments operating across teams, universities, and datasets while enabling university IT stakeholders to manage, monitor, and control spending, apply security best practices, and comply with corporate governance.
t-young31/terraform-aws-vslurm
Create a virtual Slurm cluster on AWS using Terraform.
t-young31/terraform-cloudflare-arc-dns
Terraform module that creates DNS records on Cloudflare
t-young31/terraform-gha-runners-k8s
Terraform install of GitHub actions runners on Kubernetes
t-young31/xnat-helm-charts
t-young31/xnat-k8s-prototype