Energy-based Graph Convolutional Networks for Scoring Protein Docking Models
☆11Aug 31, 2021Updated 5 years ago
Alternatives and similar repositories for EGCN
Users that are interested in EGCN are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Bayesian Active Learning for Optimization and Uncertainty Quantification with Applications to Protein Docking☆13Apr 28, 2021Updated 5 years ago
- [NeurIPS 2019] LOIS: Learning to Optimize In Swarms, guided by posterior estimation☆18Aug 14, 2021Updated 5 years ago
- Learning protein representation for rigid-body docking☆22Nov 2, 2019Updated 6 years ago
- Guided Conditional Wasserstein GAN for De Novo Protein Design☆35Feb 23, 2021Updated 5 years ago
- SPVec: A Word2vec-inspired feature representation method for Drug-Target Interaction Prediction☆20Jan 8, 2020Updated 6 years ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- Mirror of https://codeberg.org/rvhonorato/gdock >> development happens on Codeberg☆20Jul 7, 2026Updated 3 months ago
- A Memetic Algorithm boosts accuracy and speed of all-atom protein-protein docking☆29Jul 5, 2025Updated last year
- Deep Generative Models for Drug Combination (Graph Set) Generation given Hierarchical Disease Network Embedding☆32Mar 25, 2023Updated 3 years ago
- iScore: an MPI supported software for ranking protein-protein docking models based on a random walk graph kernel and support vector machi…☆31Jun 25, 2022Updated 4 years ago
- Simple CLI to extract messages (SMS/iMessage) to CSV from iPhone backups☆17Dec 6, 2018Updated 7 years ago
- Game of Go implemented in Python☆10Jan 1, 2020Updated 6 years ago
- inferring RBP binding sites and motifs using local and global CNNs☆21Sep 29, 2019Updated 7 years ago
- ☆10Jun 8, 2023Updated 3 years ago
- ☆29Aug 29, 2023Updated 3 years ago
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- Modified Pytorch Lightning implementation of paper:-https://jcheminf.biomedcentral.com/track/pdf/10.1186/s13321-019-0407-y☆10Dec 22, 2020Updated 5 years ago
- ☆10Apr 25, 2024Updated 2 years ago
- ☆13May 24, 2026Updated 5 months ago
- Deep reinforcement learning for protein complex modeling☆11May 28, 2022Updated 4 years ago
- Python Bioinformatics Toolkit for CATH (Protein Classification Database @ UCL)☆17Sep 30, 2024Updated 2 years ago
- ☆34Jul 27, 2026Updated 3 months ago
- RLMM is a reinforcement learning env for molecular modeling (currently only protein-ligand docking).☆11Nov 14, 2022Updated 3 years ago
- ☆13Jun 7, 2024Updated 2 years ago
- ☆13Oct 3, 2017Updated 9 years ago
- Deploy open-source AI quickly and easily - Special Bonus Offer • AdRunpod Hub is built for open source. One-click deployment and autoscaling endpoints without provisioning your own infrastructure.
- Docking viewer plug-in for PyMOL☆11Oct 7, 2024Updated 2 years ago
- Building more accurate protein structures from backbone torsion angles☆16Mar 21, 2025Updated last year
- Software for analyzing multiple protein-protein interaction docking solutions, calculating contact regions using mdtraj, and visualizing …☆12Jun 16, 2017Updated 9 years ago
- ☆13Jun 7, 2025Updated last year
- ☆14Jun 25, 2022Updated 4 years ago
- [Bioinformatics 2022] Cross-Modality and Self-Supervised Protein Embedding for Compound-Protein Affinity and Contact Prediction☆16Jun 6, 2024Updated 2 years ago
- 🚬前端自动化测试理论到实战☆12Apr 20, 2021Updated 5 years ago
- ProteinFeatureAnalyzer extracts, analyzes and visualizes features from protein structures.☆14Mar 14, 2020Updated 6 years ago
- GeoSSL: Molecular Geometry Pretraining with SE(3)-Invariant Denoising Distance Matching, ICLR'23 (https://openreview.net/forum?id=CjTHVo1…☆49Jul 27, 2023Updated 3 years ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- ☆17Dec 10, 2024Updated last year
- Software for the analysis and visualization of site-saturation mutagenesis experiments☆19Apr 21, 2023Updated 3 years ago
- Transformer-based protein function Annotation with joint feature-Label Embedding☆38Dec 18, 2024Updated last year
- Tool(s) for cleaning, munging and analysing PDB files for structural bioinformatics analysis.☆15May 29, 2019Updated 7 years ago
- De novo design of small molecule binding sites into proteins☆11Apr 14, 2021Updated 5 years ago
- A Generative Adversarial Network Model Alternative to Animal Studies for Clinical Pathology Assessment☆18Jan 10, 2024Updated 2 years ago
- Distributed Feedback-Looped Networks☆10Jan 15, 2020Updated 6 years ago