☆12Feb 14, 2024Updated 2 years ago
Alternatives and similar repositories for ALIGNNTL
Users that are interested in ALIGNNTL are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆14Jul 13, 2025Updated 8 months ago
- Unofficial implementation of the Ask-LLM paper 'How to Train Data-Efficient LLMs', arXiv:2402.09668.☆12Jun 19, 2024Updated last year
- An SE(3)-invariant autoencoder for generating the periodic structure of materials [ICLR 2022]☆26Oct 8, 2024Updated last year
- Performance Benchmark of E3SM's I/O Kernel☆16Feb 17, 2026Updated last month
- Atomistic Line Graph Neural Network https://scholar.google.com/citations?user=9Q-tNnwAAAAJ https://www.youtube.com/@dr_k_choudhary☆306Aug 25, 2025Updated 7 months ago
- End-to-end encrypted cloud storage - Proton Drive • AdSpecial offer: 40% Off Yearly / 80% Off First Month. Protect your most important files, photos, and documents from prying eyes.
- Repo for the paper "Exploiting redundancy in large materials datasets for efficient machine learning with less data"☆11Sep 23, 2024Updated last year
- Optimized Generative Adversarial Network with Graph Convolutional Networks for Novel Molecule Design☆12Jan 2, 2024Updated 2 years ago
- Using the CGCNN transfer learning model to pridict the voltages of many kinds of metal-ion battery electrodes☆11Aug 23, 2022Updated 3 years ago
- Illustrating how to publish battery data☆13May 27, 2025Updated 10 months ago
- Neural force field learning toolkit☆14Dec 22, 2025Updated 3 months ago
- ☆14Apr 15, 2024Updated last year
- ☆12Jul 2, 2025Updated 8 months ago
- Keras (TensorFlow v2) reimplementation of Re-parameterized Large Kernel Network (RepLKNet)☆17Dec 8, 2022Updated 3 years ago
- AlphaCrytal: Contact map based deep learning algorithm for crystal structure prediction☆11Aug 18, 2023Updated 2 years ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- Universal atomic embedding based on crystalTransfomer☆25Jan 11, 2025Updated last year
- CrysText: A Generative AI Approach for Text-Conditioned Crystal Structure Generation using LLM☆16Nov 3, 2025Updated 4 months ago
- The PyTorch implementation of ML framework for predicting band structure, taking an example of graphene nanoribbon systems.☆12Oct 6, 2022Updated 3 years ago
- ☆11Dec 15, 2023Updated 2 years ago
- Twin-deep neural network for semi-supervised learning of materials properties☆12Feb 1, 2023Updated 3 years ago
- Deep Learning the Chemistry of Materials From Only Elemental Composition for Enhancing Materials Property Prediction☆103Jan 13, 2026Updated 2 months ago
- The official code respository for "Crystalformer: Infinitely Connected Attention for Periodic Structure Encoding" (ICLR 2024)☆28Mar 8, 2025Updated last year
- Tool to manage purchase and sale of commodity in hledger using FIFO or AVERAGE COST☆15May 15, 2024Updated last year
- High-Throughput Computational Physics Framework☆13Oct 25, 2017Updated 8 years ago
- DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- Conditional Constrained Graph Variational Autoencoders (CCGVAE) for Molecule Design☆20Sep 20, 2020Updated 5 years ago
- Predicting new perovskites with ensemble Machine Learning algorithms☆16Nov 8, 2025Updated 4 months ago
- source code of (quasi-)Givens Orthogonal Fine Tuning integrated to peft lib☆17Mar 13, 2025Updated last year
- [IEEE TGRS] SphereNet: Learning a Noise-Robust and General Descriptor for Point Cloud Registration☆19Dec 24, 2023Updated 2 years ago
- Scalable graph neural networks for materials property prediction☆63Feb 2, 2026Updated last month
- [NeurIPS 2024] Official code for the paper 'RankUp: Boosting Semi-Supervised Regression with an Auxiliary Ranking Classifier'☆14Aug 22, 2025Updated 7 months ago
- PELA: Learning Parameter-Efficient Models with Low-Rank Approximation [CVPR 2024]☆19Apr 14, 2024Updated last year
- ☆19Jul 1, 2023Updated 2 years ago
- A python-based crystal viewer built upon the fresnel and pymatgen libraries.☆16May 20, 2024Updated last year
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click and start building anything your business needs.
- Transformer model for structure-agnostic metal-organic frameworks (MOF) property prediction☆62Sep 10, 2023Updated 2 years ago
- Simplifying the discovery and usage of machine-learning ready datasets in materials science and chemistry☆85Jan 22, 2026Updated 2 months ago
- Large language models, physics-based modeling, experimental measurements: the trinity of data-scarce learning of polymer properties☆14Sep 4, 2025Updated 6 months ago
- This repository contains organizational notes and details for the CECAM MADICES workshop, 7th-9th February 2022.☆13Feb 22, 2022Updated 4 years ago
- ☆18Nov 12, 2022Updated 3 years ago
- Extract structure-functions from data using XAI and LLMs☆27Jan 20, 2025Updated last year
- Algorithms to analyze and predict molecular structures☆24Jul 4, 2025Updated 8 months ago