Resources for Generalisable Protein Complex Prediction
☆19Oct 16, 2024Updated last year
Alternatives and similar repositories for moving_beyond_memorisation
Users that are interested in moving_beyond_memorisation are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- DataSAIL is a tool to split datasets while reducing information leakage.☆51May 16, 2026Updated last week
- The BigBind protein-ligand binding dataset (and BayesBind benchmark)☆20Nov 14, 2024Updated last year
- PINDER: The Protein INteraction Dataset and Evaluation Resource☆155Nov 15, 2024Updated last year
- DiAMoNDBack: Diffusion-denoising Autoregressive Model for Non-Deterministic Backmapping of Cα Protein Traces☆18May 7, 2025Updated last year
- Protein Ligand INteraction Dataset and Evaluation Resource☆288May 13, 2026Updated last week
- 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.
- Denoising diffusion probabilistic models for replica exchange☆24Feb 19, 2022Updated 4 years ago
- Implementation of the Confidence Bootstrapping procedure for protein-ligand docking.☆27Feb 29, 2024Updated 2 years ago
- Source code of MOLLEO☆56Jul 8, 2025Updated 10 months ago
- A user-friendly library that brings familiar DataFrame-style operations to AnnData objects with a simple and expressive API.☆17Updated this week
- Compilation of literature examples of generative drug design that demonstrate experimental validation☆59Jul 3, 2025Updated 10 months ago
- ☆13Mar 16, 2024Updated 2 years ago
- Repository for "Nearest neighbor search on embeddings rapidly identifies distant protein relations"☆13Apr 2, 2023Updated 3 years ago
- Disordered protein ensemble prediction☆14Apr 2, 2026Updated last month
- Mol* as anywidget☆54Oct 13, 2025Updated 7 months ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- Docking Tool Benchmarking Workflow☆25Jul 17, 2024Updated last year
- bioinformatics tools running on modal☆156Feb 18, 2026Updated 3 months ago
- Datasets for P2Rank project. https://github.com/rdk/p2rank☆27Nov 8, 2024Updated last year
- Fisher deep domain adaptation for astronomy - galaxy mergers☆11Nov 21, 2022Updated 3 years ago
- Activity-Cliff Awareness Enables Robust Graph Learning for Molecular Property Prediction☆48Apr 20, 2026Updated last month
- Code for the paper Context-Guided Diffusion for Out-of-Distribution Molecular and Protein Design☆40Feb 21, 2026Updated 3 months ago
- Program Package for Sampling, Training and Applying ML-based Potential models☆12Updated this week
- ☆18Jun 26, 2023Updated 2 years ago
- Target-aware Variational Auto-encoders for Ligand Generation with Multimodal Protein Representation Learning☆32May 17, 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.
- POC Nextflow pipeline to run the Chai-1, SOTA model for biomolecular structure prediction☆11Apr 16, 2026Updated last month
- Spreadsheet template files for 9x9 and 10x10 tube storage boxes for freezing biological samples☆12Apr 18, 2025Updated last year
- When you face some problem in drug discovery, just delete☆13Aug 3, 2024Updated last year
- Batched Energy-Entropy acquisition for Bayesian Optimization (NeurIPS 2024)☆11Jan 6, 2025Updated last year
- ProteinDesign with RFdiffusion and ProteinMPNN/LigandMPNN☆23Mar 6, 2025Updated last year
- Implementation of Protein Invariant Point Packer (PIPPack)☆35May 28, 2024Updated last year
- Send data to and from pymol from a remote server (e.g. a cluster running deep learning workflows)☆37Feb 17, 2025Updated last year
- Workflow to clean up and fix structural problems in protein-ligand binding datasets☆79Mar 18, 2026Updated 2 months ago
- ☆16Sep 30, 2024Updated last year
- 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.
- ☆22Dec 1, 2025Updated 5 months ago
- A benchmark dataset for protein-ligand co-folding prediction☆63Aug 13, 2025Updated 9 months ago
- A Unified Approach to Protein Engineering☆41Jul 2, 2024Updated last year
- ☆23Feb 4, 2025Updated last year
- A geometric flow matching model for generative protein-ligand docking and affinity prediction. (ISMB 2025)☆137Sep 3, 2025Updated 8 months ago
- Biological prediction models made simple.☆50May 18, 2026Updated last week
- Fast, parallelized implementation of Principal Component Analysis with constant memory consumption for large data sets.☆12Feb 18, 2022Updated 4 years ago