Electron-density-informed effective and reliable de novo molecular design and optimization with ED2Mol
☆137Apr 1, 2026Updated 6 months ago
Alternatives and similar repositories for ED2Mol
Users that are interested in ED2Mol are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- A universal structure-directed lead optimization☆80Jan 30, 2026Updated 8 months ago
- ☆78Nov 7, 2025Updated 11 months ago
- [CVPR 2026] PromptEnhancer is a prompt-rewriting tool, refining prompts into clearer, structured versions for better image generation.☆3,782Aug 18, 2026Updated last month
- TVM Documentation in Chinese Simplified / TVM 中文文档☆3,951May 20, 2026Updated 4 months ago
- ☆22Updated this week
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- Open-source agent platform for Global × China enterprises — wire every system through one agent core. Self-hosted, any LLM.☆1,573Updated this week
- Klavis AI: MCP integration platforms that let AI agents use tools reliably at any scale☆5,807Jun 1, 2026Updated 4 months ago
- A web-based novel drug design platform for up-to-date bioisosteric replacement☆30May 13, 2026Updated 4 months ago
- This Code is for Fragment-wise 3D Structure-based Molecular Generation with Reliable Geometry☆35Mar 24, 2025Updated last year
- Multi-domain Distribution Learning for De Novo Drug Design☆168Jan 26, 2026Updated 8 months ago
- Translate PDF, Word, PowerPoint, etc. | zotero翻译插件，微信扫码注册，新用户可免费翻译25万汉字或100万个英文字母。超能文献官网:suppr.wilddata.cn；☆2,015Aug 25, 2026Updated last month
- Align Anything: Training All-modality Model with Feedback☆4,666Nov 27, 2025Updated 10 months ago
- Implementation of “Bridging 3D Molecular Structures and Artificial Intelligence by a Conformation Description Language”☆37Sep 4, 2026Updated last month
- Merging, linking and placing compounds by stitching bound compounds together like a reanimated corpse☆12Feb 22, 2024Updated 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.
- 3D_Molecular_Generation☆116Nov 23, 2024Updated last year
- LimiX: Unleashing Structured-Data Modeling Capability for Generalist Intelligence https://arxiv.org/abs/2609.17488☆4,375Sep 18, 2026Updated 3 weeks ago
- ☆1,842Feb 14, 2026Updated 7 months ago
- ☆86Feb 17, 2026Updated 7 months ago
- Nexent is a zero-code platform for auto-generating production-grade AI agents using Harness Engineering principles — unified tools, skill…☆5,900Updated this week
- ☆17Sep 4, 2023Updated 3 years ago
- 🔥minerproxy,minerproxy,minerproxy,minerproxy,minerproxy,minerproxy,minerproxy,minerproxy,minerproxy,minerproxy,矿池抽水,矿池中转,矿场运维专用☆3,708Jul 15, 2026Updated 2 months ago
- Joint Semantic Detection and Dissemination Control of Phishing Attacks on Social Media via LLama- Based Modeling☆1,012Feb 15, 2026Updated 7 months ago
- A Python-first runtime layer for multi-agent systems, with persistent run state, streaming execution events, and a pluggable orchestratio…☆1,105Updated this week
- Open source password manager - Proton Pass • AdSecurely store, share, and autofill your credentials with Proton Pass, the end-to-end encrypted password manager trusted by millions.
- The next generation deep reinforcement learning tookit☆3,466Jun 16, 2023Updated 3 years ago
- SurfDock is a Surface-Informed Diffusion Generative Model for Reliable and Accurate Protein-ligand Complex Prediction☆257Sep 29, 2025Updated last year
- AI-powered tool for efficient abstract and PDF screening in systematic reviews.☆1,336Jun 11, 2026Updated 3 months ago
- OpenCode Cover.☆1,627Jun 17, 2026Updated 3 months ago
- This is the GitHub repository accompanying Krishnan, Anahtar, Valeri, et al., 2025☆41Jun 8, 2025Updated last year
- Vina-GPU 2.1, an improved docking toolkit for faster speed and higher accuracy on the virtual screening☆176Oct 1, 2024Updated 2 years ago
- ☆157Sep 24, 2026Updated 2 weeks ago
- 💰唯一正版💰 minerproxy minerproxy minerproxy minerproxy minerproxy minerproxy minerproxy minerproxy minerproxy minerproxy 矿池抽水 矿池代理 矿池中转 矿池抽…☆3,880Oct 2, 2026Updated last week
- 数字底座是一款面向大型政府、企业数字化转型，基于身份认证、组织架构、岗位职务、应用系统、资源角色、数据目录、安全控制等功能构建的统一且安全的管理支撑平台。数字底座基于三员管理模式，具备微服务、多租户、容器化和国产化，支持用户利用代码生成器快速构建自己的业务应用，同时可关联诸…☆2,613Sep 29, 2026Updated last week
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- ☆42Mar 26, 2025Updated last year
- Implementation of PocketXMol, the pocket-interacting molecular generative foundation model.☆258Mar 22, 2026Updated 6 months ago
- AI for Science 论文解读合集（持续更新ing），论文/数据集/教程下载：hyper.ai☆3,378Jul 22, 2026Updated 2 months ago
- PackDock: a Diffusion Based Side Chain Packing Model for Flexible Protein-Ligand Docking☆65Mar 30, 2026Updated 6 months ago
- An agent capable of self-evolving and dynamically hardening security☆2,575Jul 27, 2026Updated 2 months ago
- Foundations of Medical Large Language Model Learning☆2,130May 27, 2026Updated 4 months ago
- ECloudGen: Leverage Quantum Physics to Scale Chemical Space for Structure-based Molecular Design☆19Feb 27, 2025Updated last year