Multi-view of text and graph
☆11Jul 3, 2025Updated last year
Alternatives and similar repositories for multi-view
Users that are interested in multi-view are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- LLM-agent for catalyst research☆10Jun 12, 2025Updated last year
- FireWorks and Atomate Tutorial☆11Jan 25, 2023Updated 3 years ago
- CuPd cluster expansion calculations☆12Oct 27, 2016Updated 10 years ago
- [ICML'24] Adsorbate Placement via Conditional Denoising Diffusion☆25May 9, 2024Updated 2 years ago
- Theory Infused Neural Network☆12Sep 26, 2026Updated last month
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- Wyckoff Inorganic Crystal Generator Framework☆29Mar 7, 2025Updated last year
- Text-based modeling of materials.☆44Aug 14, 2026Updated 2 months ago
- ☆15Jul 22, 2026Updated 3 months ago
- 本项目为北航2023年《机器学习》课程代码示例☆11Dec 1, 2023Updated 2 years ago
- Multimodal Transformer for Predicting Global Minimum Adsorption Energy☆31Apr 5, 2025Updated last year
- This repository includes software for the paper "Multi-task learning for molecular electronic structure approaching coupled-cluster accur…☆25Oct 3, 2024Updated 2 years ago
- Workflow for creating and analyzing the Open Catalyst Dataset☆132Feb 5, 2025Updated last year
- simple CBIR(Content based Image Retrieval) system with flask web UI☆10Dec 26, 2022Updated 3 years ago
- Examples and utilities for molecular dynamics simulations☆18May 18, 2026Updated 5 months ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- UniSolar: A collaborative framework for unifying typical multidimensional solar cell simulations☆11Apr 11, 2026Updated 7 months ago
- Atom-by-atom design of metal oxide catalysts for the oxygen evolution reaction with Machine Learning☆13Oct 19, 2023Updated 3 years ago
- CatBench - Benchmark Framework of Machine Learning Interatomic Potentials in Adsorption Energy Predictions☆60Oct 19, 2026Updated 3 weeks ago
- ☆14Oct 2, 2024Updated 2 years ago
- Machine Learning for Catalysis☆20May 25, 2023Updated 3 years ago
- ☆14Oct 16, 2022Updated 4 years ago
- Large Language Model for Catalyst Property Prediction☆29Mar 8, 2024Updated 2 years ago
- An SE(3)-invariant autoencoder for generating the periodic structure of materials [ICLR 2022]☆26Oct 8, 2024Updated 2 years ago
- Code for "Applying Large Graph Neural Networks to Predict Transition Metal Complex Energies Using the tmQM_wB97MV Dataset"☆12Apr 9, 2024Updated 2 years ago
- Serverless GPU API endpoints on Runpod - Get Bonus Credits • AdSkip the infrastructure headaches. Auto-scaling, pay-as-you-go, no-ops approach lets you focus on innovating your application.
- Code to compute electronic and steric features to create a database of ligands and their properties☆19Jan 11, 2022Updated 4 years ago
- Fast estimation of ion-pairing for screening electrolytes☆11Aug 23, 2022Updated 4 years ago
- Flan T5 LLM fine-tuning, by attaching a regression model last hidden layers activations. Runs on colab with A100 40gb☆13Mar 24, 2023Updated 3 years ago
- This is the Python code and original data of "Machine-Learning Guided Discovery and Optimization of Additives in Preparing Cu Catalyst fo…☆14Mar 16, 2023Updated 3 years ago
- Diffusion models for disordered materials☆25Nov 18, 2025Updated 11 months ago
- 每日自动抓取 GitHub Trending，用 LLM 生成项目深度分析（点评 / 亮点 / 影响），产出 Markdown / HTML 报告与 Vue 3 交互式趋势看板，支持收藏。☆12Oct 28, 2026Updated 2 weeks ago
- The official PyTorch implementation of SMICLR: Contrastive Learning on Multiple Molecular Representations for Semisupervised and Unsuperv…☆12Sep 7, 2025Updated last year
- Prediction of reaction free energies with machine learning☆10Sep 28, 2021Updated 5 years ago
- ☆13Sep 8, 2021Updated 5 years ago
- AI Agents on 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.
- ☆15Dec 18, 2023Updated 2 years ago
- Large language models to generate stable crystals.☆122Jun 18, 2024Updated 2 years ago
- ☆17Nov 10, 2025Updated last year
- Web-Scarping tool for downloading the content of the following publishers: Elsevier, RSC, Web of Science, Springer Nature , Wiley.☆42Jun 24, 2025Updated last year
- ☆11Jan 31, 2025Updated last year
- Demonstrator for the effectiveness of transformer models, specifically the newly released ChemBERTa-2, in predicting physical-chemical pr…☆17Mar 1, 2026Updated 8 months ago
- Semi-supervised learning code + CAVD + BVSE + QE-NEB for identifying prospective ion conductors☆15Sep 24, 2022Updated 4 years ago
Are these results useful?