Gxy-with-luv / AFF2024View external linksLinks
No description yet.
☆17Aug 8, 2024Updated last year
Alternatives and similar repositories for AFF2024
Users that are interested in AFF2024 are comparing it to the libraries listed below
Sorting:
- Baseline model for PPB-Affinity benchmark data☆34May 21, 2025Updated 8 months ago
- Modelling protein conformational landscape with Alphafold☆55Aug 29, 2025Updated 5 months ago
- LAST: Latent Space Assisted Adaptive Sampling for Protein Trajectories☆13Dec 17, 2022Updated 3 years ago
- Repository containing scripts and analysis for ML-Guided Acyl-ACP Reductase Engineering paper☆11Nov 21, 2023Updated 2 years ago
- A new python package to visualize molecules in dots hover☆13Feb 15, 2024Updated 2 years ago
- ☆13Dec 5, 2024Updated last year
- DSDPFlex: Flexible-Receptor Docking with GPU Acceleration☆23Dec 24, 2025Updated last month
- Code for deep learning guided design of dynamic proteins☆32Jul 16, 2024Updated last year
- ☆14Sep 27, 2024Updated last year
- ☆11May 3, 2025Updated 9 months ago
- CosolvKit is a versatile tool for cosolvent MD preparation and analysis☆29Oct 22, 2025Updated 3 months ago
- ☆13Jul 11, 2023Updated 2 years ago
- Analysis and design of protein-protein or protein-peptide interactions based on atlas database.☆15Sep 27, 2022Updated 3 years ago
- Code for designing biased protein states☆59Nov 20, 2025Updated 2 months ago
- ☆16Updated this week
- ☆18Aug 5, 2023Updated 2 years ago
- ☆61Apr 9, 2024Updated last year
- Official repository for DiffPepBuilder and DiffPepDock tools☆117Oct 24, 2025Updated 3 months ago
- ☆39Jun 12, 2025Updated 8 months ago
- ☆35Oct 14, 2024Updated last year
- HyperMPNN ‒ A general strategy to design thermostable proteins learned from hyperthermophiles☆72Jul 2, 2025Updated 7 months ago
- Fast protein backbone flexibility prediction model☆34Jan 4, 2026Updated last month
- ☆19Mar 16, 2025Updated 11 months ago
- Python rich client for visual protein Sequence to Structure Analysis☆18Oct 12, 2025Updated 4 months ago
- P2DFlow: A Protein Ensemble Generative Model with SE(3) Flow Matching☆44May 22, 2025Updated 8 months ago
- Improved protein complex prediction with AlphaFold-multimer by denoising the MSA profile☆72Aug 26, 2024Updated last year
- Fast AlphaFold-Multimer based pipeline for Protein-Protein Interaction (PPI) screening☆39Sep 27, 2024Updated last year
- Pharmacophore Elucidation with Convolutional Neural Networks and Reinforcement Learning☆16Apr 7, 2025Updated 10 months ago
- Repo for the publication titled: "Key Interaction Networks: Identifying Evolutionarily Conserved Non-Covalent Interaction Networks Across…☆18Nov 14, 2023Updated 2 years ago
- ☆18Sep 16, 2024Updated last year
- A convinent tool to visualize AlphaFold 3 prediction results with PyMOL and matplotlib☆19May 20, 2024Updated last year
- Histidine Protonation State Optimizer for setting up MD simulations based on semi-empirical QM resonance☆20Jan 26, 2026Updated 3 weeks ago
- Fast and accurate molecular docking with an AI pose scoring function☆42Feb 8, 2024Updated 2 years ago
- Predict multiple protein conformations using sequence clustering and AlphaFold2.☆175Oct 7, 2025Updated 4 months ago
- Rapid structure-based virtual screening for RNA targets.☆26Updated this week
- Official Implementation of CompassDock☆21Oct 8, 2024Updated last year
- Quantitative Estimate Index for Early-Stage Screening of Compounds Targeting Protein-Protein Interactions☆18Nov 28, 2023Updated 2 years ago
- Official open-source of Accurate structure prediction of immune proteins using parameter-efficient transfer learning☆22Mar 19, 2025Updated 10 months ago
- A 3D-equivariant neural network for protein structure accuracy estimation☆20Feb 24, 2023Updated 2 years ago