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Andrew White

Username    whitead
Date joined   Joined

27 projects

paper-qa

Last released

LLM Chain for answering questions from docs

ldp

Last released

Agent framework for constructing language model agents and training on constructive tasks.

pqapi

Last released

API for interacting with paperqa.app

fhaviary

Last released

Gymnasium framework for training language model agents on constructive tasks

aviary.hotpotqa

Last released

HotPotQA environment implemented with aviary

aviary.gsm8k

Last released

GSM8k environment implemented with aviary

symd

Last released

Symmetric Molecular Dynamics

ternviz

Last released

Render SMILES into 3D video

chemcrow

Last released

Accurate solution of reasoning-intensive chemical tasks, powered by LLMs.

molbloom

Last released

Purchaseable SMILES filter

skunk

Last released

Insert SVGs into matplotlib figures

bolift

Last released

BayesOPT with LIFT

exmol

Last released

Counterfactual generation with STONED SELFIES

autosmith

Last released

Make tools quickly automatically

rmrkl

Last released

Robust Modular Reasoning, Knowledge and Language agent that uses tools and retries on failure

nmrgnn-data

Last released

Chemical shift prediction dataset

synspace

Last released

Generative model based on forward synthesis rules

nlcc

Last released

Natural language computational chemistry

vdict

Last released

A dict with a vector index for fast lookup of nearest neighbors

dmol-book

Last released

Style and Imports for dmol Book

emojichem

Last released

Replace elements with emojis in rdkit

wazy

Last released

Pretrained Bayesian Optimization of Sequences

molcloud

Last released

Insert SVGs into matplotlib figures

kdeepensemble

Last released

Deep ensembles for Keras

shadyquant

Last released

Shaded quantile plot

maxent-infer

Last released

Maximum entropy inference Keras implementation

nmrgnn

Last released

Chemical shift predictor

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