matthart97

KAN4Graph

Kolmogorov Arnold Networks (KANs) for Graph Neural Networks (GNNs) and Tasks on Graphs

GraphKAN-Graph-Kolmogorov-Arnold-Networks

pykan

Kolmogorov Arnold Networks

nougat

Implementation of Nougat Neural Optical Understanding for Academic Documents

grobid

A machine learning software for extracting information from scholarly documents

jeebench

JEEBench, EMNLP 2023

owlready2_cheatsheet

Code that illustrates some of owlready2 functionality to parse an owl file

langchain

🦜🔗 Build context-aware reasoning applications

pyscf

Python module for quantum chemistry

cdk

The Chemistry Development Kit

ollama

Get up and running with Llama 3, Mistral, Gemma 2, and other large language models.

langgraph

Build resilient language agents as graphs.

ocelotml_2d

This repository contains the code to download the OCELOT chromophore dataset and use the pretrained models to make predictions

xTuring

Build, customize and control you own LLMs. From data pre-processing to fine-tuning, xTuring provides an easy way to personalize open-source LLMs. Join our discord community: https://discord.gg/TgHXuSJEk6

awesome-explainable-graph-reasoning

A collection of research papers and software related to explainability in graph machine learning.

rl_experiments

uvvisml

Predict optical properties of molecules with machine learning.

machine-learning-resources

List of books and other resources that are related to deep learning

Papers-Literature-ML-DL-RL-AI

Highly cited and useful papers related to machine learning, deep learning, AI, game theory, reinforcement learning

camel

🐫 CAMEL: Finding the Scaling Law of Agents. A multi-agent framework. https://www.camel-ai.org

PN2S

MTL_ChiParameter

Sample code for "Predicting polymer-solvent miscibility using machine-learned Flory-Huggins interaction parameters

solubility-prediction-paper

reinvent-randomized

Recurrent Neural Network using randomized SMILES strings to generate molecules

ontogpt

LLM-based ontological extraction tools, including SPIRES

arxiv-public-datasets

A set of scripts to grab public datasets from resources related to arXiv

axolotl

Go ahead and axolotl questions

playing-with-falcon

webprotege

The webprotege code base

molformer

Repository for MolFormer