Synthesizable 3D Molecule Generation via Joint Reaction and Coordinate Modeling
☆31Jun 3, 2026Updated last month
Alternatives and similar repositories for SynCoGen
Users that are interested in SynCoGen are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ⛰️ PrexSyn: Efficient and Programmable Exploration of Synthesizable Chemical Space☆55Updated this week
- Synthetic Accessibility via Fragment Assembly Generation☆24Jul 3, 2026Updated 3 weeks ago
- ☆20Dec 5, 2024Updated last year
- ☆25Jan 30, 2025Updated last year
- ☆19Feb 27, 2026Updated 4 months ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- ☆68Jun 27, 2025Updated last year
- Design scripts corresponding to "Computational design of sequence-specific DNA-binding proteins."☆21Oct 23, 2025Updated 9 months ago
- ☆138Jul 14, 2026Updated last week
- A geometric flow matching model for generative protein-ligand docking and affinity prediction. (ISMB 2025)☆141Sep 3, 2025Updated 10 months ago
- GatorAffinity: Boosting Protein-Ligand Binding Affinity Prediction with Large-Scale Synthetic Structural Data☆35Apr 10, 2026Updated 3 months ago
- Multi-domain Distribution Learning for De Novo Drug Design☆163Jan 26, 2026Updated 5 months ago
- ☆33Mar 11, 2023Updated 3 years ago
- ☆14Mar 31, 2026Updated 3 months ago
- ☆78Feb 17, 2026Updated 5 months 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.
- Merging, linking and placing compounds by stitching bound compounds together like a reanimated corpse☆12Feb 22, 2024Updated 2 years ago
- Official repository of Zatom-1, a general-purpose model for 3D molecules and materials☆50May 13, 2026Updated 2 months ago
- ReaSyn is a model for predicting a molecule's synthesis pathway, reaction steps from building blocks to final product(s), using an encode…☆106Jul 18, 2026Updated last week
- PhoreGen: Pharmacophore-Oriented 3D Molecular Generation towards Efficient Feature-Customized Drug Discovery https://www.nature.com/artic…☆39Jan 26, 2026Updated 5 months ago
- ☆15Jun 3, 2025Updated last year
- Mixed continous/categorical flow-matching model for de novo molecule generation.☆213Apr 26, 2026Updated 2 months ago
- A Multi-Task Generative model for Structure-Based Drug Design☆68Updated this week
- ICLR 2025 paper: 3DMolFormer: A Dual-channel Framework for Structure-based Drug Discovery☆32Apr 25, 2025Updated last year
- [ICLR 2025] "Fast and Accurate Blind Flexible Docking"☆16Feb 16, 2025Updated last year
- 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.
- [ICML 25'] Compositional Flows for 3D Molecule and Synthesis Pathway Co-design☆19Dec 1, 2025Updated 7 months ago
- A lightweight, fast pocket finder in Python.☆92Updated this week
- ☆88Jan 11, 2025Updated last year
- ☆21Nov 13, 2025Updated 8 months ago
- ☆29Apr 16, 2026Updated 3 months ago
- ☆27Jun 29, 2025Updated last year
- ☆16Feb 20, 2026Updated 5 months ago
- Advancing molecular machine learning representations with stereoelectronics-infused molecular graphs☆36Feb 9, 2026Updated 5 months ago
- DMFF-DTA: Dual Modality Feature Fused Neural Network Integrating Binding Site Information for Drug Target Affinity Prediction☆20Feb 18, 2025Updated 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.
- It's a package for evaluation of predicted poses, right?☆78Jul 13, 2026Updated last week
- Using a joint AE and property prediction model to estimate OOD molecules and quantify uncertainty☆27Apr 25, 2026Updated 3 months ago
- A GFlowNet with a chemical synthesis action space.☆135Jan 31, 2025Updated last year
- QUASAR is an autonomous system for end-to-end scientific discovery, integrating LLMs with simulation tools to automate workflows across q…☆18May 26, 2026Updated last month
- A fragment-based molecular assembly toolkit☆52Updated this week
- workflow used to prepare PPB-Affinity database☆34Aug 22, 2024Updated last year
- ☆40Feb 20, 2026Updated 5 months ago