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This is the offical code of the paper "Towards Large-scale Chemical Reaction Image Parsing via a Multimodal Large Language Model"

Python 26 3 Updated Aug 13, 2025

💫 Toolkit to help you get started with Spec-Driven Development

Shell 43,258 3,678 Updated Oct 23, 2025

Spec-driven development for AI coding assistants.

TypeScript 6,168 471 Updated Oct 27, 2025

🚀🚀 「大模型」2小时完全从0训练26M的小参数GPT!🌏 Train a 26M-parameter GPT from scratch in just 2h!

Python 32,004 3,687 Updated Oct 29, 2025

Auto-QChem is an automated workflow for the generation and storage of DFT calculations for organic molecules.

Python 109 22 Updated Sep 3, 2025

一个用于管理和切换 Claude Code 和 Codex 不同供应商配置的桌面应用

TypeScript 2,827 180 Updated Oct 15, 2025

A lightning-fast search engine API bringing AI-powered hybrid search to your sites and applications.

Rust 54,235 2,236 Updated Oct 29, 2025

Contexts Optical Compression

Python 18,498 1,226 Updated Oct 25, 2025

This is the official code of the paper "A Multi-Agent System Enables Versatile Information Extraction from the Chemical Literature"

Python 66 11 Updated Oct 24, 2025

[IJCAI 2024] Generate different roles for GPTs to form a collaborative entity for complex tasks.

Python 1,429 173 Updated Sep 9, 2025

A very fast visualization library for large, high-dimensional data sets.

C++ 239 44 Updated Nov 30, 2024

Cell2Sentence: Teaching Large Language Models the Language of Biology

Jupyter Notebook 654 95 Updated Oct 15, 2025

Chemical Space Visualization

Jupyter Notebook 10 Updated Sep 24, 2025

Experiments with PCA and TSNE

Jupyter Notebook 4 1 Updated Oct 14, 2025

Latest Thompson Sampling validation

Jupyter Notebook 4 1 Updated Sep 1, 2025

BitBIRCH-Lean, a memory-efficient implementation of BitBIRCH designed for high-throughput clustering of huge molecular libraries

Python 82 9 Updated Oct 29, 2025

Some useful RDKit functions

Jupyter Notebook 206 35 Updated Sep 16, 2025

BitBIRCH clustering algorithm

Python 113 28 Updated Oct 21, 2025
Python 10 7 Updated Sep 11, 2025

This repository provides a unified FastAPI and MCP wrapper for an API that converts between ChemDraw chemical names and SMILES.

Python 3 Updated Sep 12, 2025

Profile-Based Long-Term Memory for AI Applications. Memobase handles user profiles, memory events, and evolving context — perfect for chatbots, companions, tutors, customer service bots, and all ch…

Python 2,257 169 Updated Oct 28, 2025

Intelligent automation and multi-agent orchestration for Claude Code

Python 19,312 2,149 Updated Oct 24, 2025

Visualize results from SynFormer docking screen

Python 3 Updated Oct 21, 2025

The home of the SMARTS-RX project

Python 13 Updated Oct 17, 2025

Generate a timeline of your day, automatically

Swift 3,796 158 Updated Oct 24, 2025

⚡ A Simple / Speedy / Secure Link Shortener with Analytics, 100% run on Cloudflare.

Vue 5,665 3,603 Updated Sep 7, 2025

Code for 🌍 UI-Simulator: LLMs as Scalable, General-Purpose Simulators For Evolving Digital Agent Training

Python 8 Updated Oct 17, 2025

A CLI tool to convert your codebase into a single LLM prompt with source tree, prompt templating, and token counting.

Rust 6,695 375 Updated Oct 28, 2025

Code complementing our manuscript on the prediction of chemical reaction yields (https://iopscience.iop.org/article/10.1088/2632-2153/abc81d) and data augmentation strategies (https://doi.org/10.26…

Jupyter Notebook 128 27 Updated Aug 5, 2022

Odoo. Open Source Apps To Grow Your Business.

Python 46,942 30,196 Updated Oct 29, 2025
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