☆19Sep 4, 2025Updated 11 months ago
Alternatives and similar repositories for MOL-Mamba
Users that are interested in MOL-Mamba are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Tree-Invent: A novel molecular generative model constrained with topological tree☆14Jul 26, 2023Updated 3 years ago
- ☆13Jun 7, 2024Updated 2 years ago
- ☆16Oct 28, 2024Updated last year
- ☆16Mar 16, 2023Updated 3 years ago
- ☆14Dec 26, 2024Updated last year
- 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.
- ☆19Oct 26, 2024Updated last year
- ☆14Oct 9, 2024Updated last year
- Benchmarking compound activity prediction for real-world drug discovery applications☆14May 7, 2024Updated 2 years ago
- The official codes and implementations of HimGNN model in paper:"HimGNN:a novel hierarchical molecular representations learning framewor…☆23Aug 30, 2023Updated 2 years ago
- Implementation of Fragment-based Pretraining and Finetuning on Molecular Graphs (NeurIPS 2023)☆24Jun 10, 2024Updated 2 years ago
- Message Passing Neural Networks for Molecule Property Prediction☆12Jan 17, 2020Updated 6 years ago
- ☆23Mar 11, 2023Updated 3 years ago
- ☆14Oct 23, 2024Updated last year
- Extract Molecular SMILES embeddings from language models pre-trained with various objectives architectures.☆19Nov 9, 2023Updated 2 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- Bokeh extensions to plot molecules easily☆11Jul 14, 2025Updated last year
- ☆23Mar 25, 2025Updated last year
- Source code accompanying the 'MF-PCBA: Multi-fidelity high-throughput screening benchmarks for drug discovery and machine learning' paper☆34Jul 29, 2025Updated last year
- ☆12Jun 14, 2025Updated last year
- ☆11Jul 30, 2025Updated last year
- Dockerized Version of the DiffDock model from MIT☆13May 22, 2023Updated 3 years ago
- ☆31Oct 29, 2023Updated 2 years ago
- A Molecular Benchmark for Disease and Target Based Machine Learning☆25Feb 9, 2022Updated 4 years ago
- ☆13Oct 6, 2024Updated last year
- 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.
- Molecular Hypergraph Neural Network☆44Jul 4, 2025Updated last year
- 基于Spring Boot和React.js的在线评测(OJ)系统☆13Apr 14, 2025Updated last year
- ☆10Nov 17, 2020Updated 5 years ago
- Pharmacophore Elucidation with Convolutional Neural Networks and Reinforcement Learning☆18Apr 7, 2025Updated last year
- Code and datasets from the publication https://doi.org/10.1186/s13321-023-00787-9☆22Apr 21, 2024Updated 2 years ago
- ☆21Dec 22, 2024Updated last year
- ☆78Sep 17, 2023Updated 2 years ago
- ☆15Apr 14, 2023Updated 3 years ago
- ☆10Apr 20, 2022Updated 4 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.
- Subgraph-conditioned Graph Information Bottleneck (S-CGIB) is a novel architecture for pre-training Graph Neural Networks in molecular pr…☆15Nov 26, 2025Updated 8 months ago
- Code for paper: "Removing Biases from Molecular Representations via Information Maximization"☆21Apr 4, 2024Updated 2 years ago
- Code for AAAI-2024 paper: Graph Contrastive Invariant Learning from the Causal Perspective☆30Mar 11, 2024Updated 2 years ago
- ☆23Oct 2, 2024Updated last year
- ☆18Feb 2, 2026Updated 6 months ago
- Apo2Mol: 3D Molecule Generation via Dynamic Pocket-Aware Diffusion Models☆38Jul 20, 2026Updated 3 weeks ago
- A quantitative benchmark and analysis of molecular large language models.☆19Jun 3, 2025Updated last year