Hugo MacDermott-Opeskin's starred repositories
alchemiscale-pulumi
cloud provisioning, deployment, and management of alchemiscale using Pulumi
transport-analysis
A Python package to compute and analyze transport properties.
aizynthfinder
A tool for retrosynthetic planning
alpaca.cpp
Locally run an Instruction-Tuned Chat-Style LLM
openff-bespokefit
Automated tools for the generation of bespoke SMIRNOFF format parameters for individual molecules.
wdpassport-utils
WD Passport Ultra Linux Utilities
whisper.cpp
Port of OpenAI's Whisper model in C/C++