Genetic-guided GFlowNets for Sample Efficient Molecular Optimization (NeurIPS 2024)
☆20Nov 14, 2025Updated 8 months ago
Alternatives and similar repositories for genetic_gfn
Users that are interested in genetic_gfn are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Official code repository for the paper Molecule Generation with Fragment Retrieval Augmentation (NeurIPS 2024)☆31Apr 2, 2025Updated last year
- Synthesis-oriented GFlowNets on a large action space: "Generative Flows on Synthetic Pathway for Drug Design" (ICLR 2025)☆38Apr 6, 2026Updated 3 months ago
- [ICML 2023] Official code for "DevFormer: A Symmetric Transformer for Context-Aware Device Placement"☆23Dec 7, 2024Updated last year
- FraGAT: a fragment-oriented multi-scale graph attention model for molecular property prediction☆27Apr 25, 2021Updated 5 years ago
- Code for "Multi-Objective GFlowNets"☆20Jul 12, 2023Updated 3 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.
- ☆29Nov 5, 2023Updated 2 years ago
- The collection of my research papers' illustrations.☆22Oct 15, 2023Updated 2 years ago
- Official implementation of NeurIPS'23 paper "Sample-efficient Multi-objective Molecular Optimization with GFlowNets"☆20Dec 24, 2023Updated 2 years ago
- [NeurIPS 2024] "Collaboration! Towards Robust Neural Methods for Routing Problems"☆21Nov 16, 2024Updated last year
- Official codebase for GTA: Generative Trajectory Augmentation with Guidance for Offline Reinforcement Learning.☆32Nov 12, 2024Updated last year
- Official code repository for the paper Drug Discovery with Dynamic Goal-aware Fragments (ICML 2024)☆20Sep 9, 2024Updated last year
- [AAMAS 2025 Oral] CAMP: Collaborative Attention Model with Profiles for Vehicle Routing Problems☆32Dec 3, 2025Updated 7 months ago
- ☆16Jan 2, 2024Updated 2 years ago
- ☆14Mar 31, 2026Updated 3 months 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.
- multi-task learning for routing problem☆24Dec 2, 2025Updated 7 months ago
- ☆13Jul 15, 2024Updated 2 years ago
- A GFlowNet with a chemical synthesis action space.☆133Jan 31, 2025Updated last year
- Code for "RGFN: Synthesizable Molecular Generation Using GFlowNets" (NeurIPS 2024)☆30Jun 9, 2025Updated last year
- ☆34Feb 20, 2026Updated 5 months ago
- Software package for spin dynamics☆14Jul 13, 2026Updated last week
- Molecule Optimization via Fragment-based Generative Models☆44Apr 4, 2023Updated 3 years ago
- ☆15Jan 22, 2025Updated last year
- Official repository for the TMLR paper "Self-Improvement for Neural Combinatorial Optimization: Sample Without Replacement, but Improveme…☆30Jan 22, 2026Updated 5 months ago
- Proton VPN Special Offer - Get 70% off • AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- ☆19Mar 3, 2026Updated 4 months ago
- [ICML 25'] Compositional Flows for 3D Molecule and Synthesis Pathway Co-design☆19Dec 1, 2025Updated 7 months ago
- ☆20Nov 3, 2024Updated last year
- Official repository for GFACS☆37May 17, 2024Updated 2 years ago
- ☆12May 8, 2024Updated 2 years ago
- [NeurIPS 2024] Learning to Handle Complex Constraints for Vehicle Routing Problems☆45Jul 9, 2026Updated last week
- [ICML'24 Oral] Rethinking Post-Hoc Search-Based Neural Approaches for Solving Large-Scale Traveling Salesman Problems☆42Apr 6, 2025Updated last year
- GPU-accelerated molecular docking software: Uni-Dock 2☆54Updated this week
- ☆11Jun 16, 2024Updated 2 years ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- [NeurIPS 2025] PARCO: Parallel AutoRegressive Combinatorial Optimization☆56Dec 3, 2025Updated 7 months ago
- The official source code for "3D Interaction Geometric Pre-training for Molecular Relational Learning"☆23Sep 30, 2025Updated 9 months ago
- Code for memory-assisted reinforcement learning☆24Oct 19, 2020Updated 5 years ago
- Code for training a language model reaction predictor. (To accompany our paper on the OOD evaluation of reaction predictors).☆12Jan 13, 2025Updated last year
- python implementation of "Multi-Goal Multi-Agent Pickup and Delivery"☆13May 18, 2023Updated 3 years ago
- GFlowNet library specialized for graph & molecular data☆291May 21, 2026Updated last month
- ☆53Mar 24, 2025Updated last year