AdeeshKolluru

AdeeshKolluru

Config files for my GitHub profile.

AdeeshKolluru.github.io

My personal website

AdsorbDiff

[ICML'24] Adsorbate Placement via Conditional Denoising Diffusion

cdvae

An SE(3)-invariant autoencoder for generating the periodic structure of materials [ICLR 2022]

crystal-llm

Large language models to generate stable crystals.

JMP

Code for “From Molecules to Materials Pre-training Large Generalizable Models for Atomic Property Prediction”.

TextWorld-Neural-Algorithmic-Reasoning

torch_emt

PyTorch implementation of EMT potential

fairchem

FAIR Chemistry's library of machine learning methods for chemistry

Open-Catalyst-Dataset

Workflow for creating and analyzing the Open Catalyst Dataset

AdeeshKolluru/AdsorbDiff

[ICML'24] Adsorbate Placement via Conditional Denoising Diffusion

AdeeshKolluru/TextWorld-Neural-Algorithmic-Reasoning

AdeeshKolluru/torch_emt

PyTorch implementation of EMT potential

AdeeshKolluru/AdeeshKolluru

Config files for my GitHub profile.

AdeeshKolluru/AdeeshKolluru.github.io

My personal website

AdeeshKolluru/cdvae

An SE(3)-invariant autoencoder for generating the periodic structure of materials [ICLR 2022]

AdeeshKolluru/crystal-llm

Large language models to generate stable crystals.

AdeeshKolluru/CrystaLLM

A Large Language Model of the CIF format for Crystal Structure Generation

AdeeshKolluru/deepmind-research

This repository contains implementations and illustrative code to accompany DeepMind publications

AdeeshKolluru/DiffCSP

AdeeshKolluru/JMP

Code for “From Molecules to Materials Pre-training Large Generalizable Models for Atomic Property Prediction”.

AdeeshKolluru/dxtb

Efficient And Fully Differentiable Extended Tight-Binding

AdeeshKolluru/facebook-transcoder-demo

A small walkthrough of Facebook's TransCoder Pretrained model for Code Conversion

AdeeshKolluru/lie-transformer-pytorch

Implementation of Lie Transformer, Equivariant Self-Attention, in Pytorch

AdeeshKolluru/LieConv

AdeeshKolluru/llama

Inference code for LLaMA models

AdeeshKolluru/llama-recipes

The llama-recipes repository is a companion to the Llama 2 model. The repository includes scripts for fine-tuning Llama 2 on text summarisation and question answering, running inference with a fine-tuned Llama 2 model and demo apps to showcase Llama 2 usage with local, cloud, or on-prem deployment.

AdeeshKolluru/matbench

Matbench: Benchmarks for materials science property prediction

AdeeshKolluru/ocp

https://opencatalystproject.org/

AdeeshKolluru/Open-Catalyst-Dataset

Workflow for creating and analyzing the Open Catalyst Dataset

AdeeshKolluru/pytorch_scatter

PyTorch Extension Library of Optimized Scatter Operations

AdeeshKolluru/schnetpack

SchNetPack - Deep Neural Networks for Atomistic Systems

AdeeshKolluru/torchani

Accurate Neural Network Potential on PyTorch