Rajarshi Guha's starred repositories
data_for_chem
Data for our paper "Chemical Reaction Practicality Judgment via Deep Symbol Artificial Intelligence"
awesome-pretrain-on-molecules
[IJCAI 2023 survey track]A curated list of resources for chemical pre-trained models
aws-batch-python-tutorial
A tutorial for running python scripts using AWS Batch
FriendsDontLetFriends
Friends don't let friends make certain types of data visualization - What are they and why are they bad.
dataset_difficulty
"Understanding Dataset Difficulty with V-Usable Information" (ICML 2022, outstanding paper)
python-patterns
A collection of design patterns/idioms in Python
aurora-data-api
A Python DB-API 2.0 client for the AWS Aurora Serverless Data API
cheminformatics-toolkit-equivalence
Resources for benchmarking cheminformatics toolkits for equivalent molecule processing behavior
bypass-paywalls-chrome
Bypass Paywalls web browser extension for Chrome and Firefox.
math-with-slack
Rendered math (MathJax) with Slack's desktop client
cocktailApp
Shiny App to Discover Cocktails.
emacs-anywhere
Configurable automation + hooks called with application information
HdrHistogram
A High Dynamic Range (HDR) Histogram