[ICLR 2024] ProFSA: Self-supervised Pocket Pretraining via Protein Fragment-Surroundings Alignment
☆24Jun 3, 2024Updated 2 years ago
Alternatives and similar repositories for ProFSA
Users that are interested in ProFSA are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- SIU: A Million-Scale Structural Small Molecule-Protein Interaction Dataset for Unbiased Bioactivity Prediction☆17Feb 17, 2025Updated last year
- ☆14Sep 22, 2026Updated last month
- ☆12Nov 16, 2023Updated 2 years ago
- ☆16Nov 4, 2024Updated last year
- LABind: Identifying Protein Binding Ligand-Aware Sites via Learning Interactions Between Ligand and Protein☆18Aug 21, 2025Updated last year
- 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.
- Extract ligands from original PDB file☆10Nov 1, 2019Updated 7 years ago
- ☆20Oct 26, 2024Updated 2 years ago
- ☆14Aug 29, 2024Updated 2 years ago
- [ICLR 2024] "Latent 3D Graph Diffusion" by Yuning You, Ruida Zhou, Jiwoong Park, Haotian Xu, Chao Tian, Zhangyang Wang, Yang Shen☆56Jun 20, 2024Updated 2 years ago
- ☆12Dec 6, 2025Updated 10 months ago
- [ICLR 2025] CheapNet: Cross-attention on Hierarchical representations for Efficient protein-ligand binding Affinity Prediction☆13Mar 13, 2025Updated last year
- ☆25Jul 22, 2025Updated last year
- ☆34Feb 28, 2022Updated 4 years ago
- Human-AI Co-discovery system☆16Jul 2, 2026Updated 4 months ago
- 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.
- Chemical Science 2023: An equivariant generative framework for molecular graph-structure Co-design☆10Jun 18, 2023Updated 3 years ago
- Implementation of GraphNVP(https://arxiv.org/abs/1905.11600) using PyTorch.☆13Jun 12, 2021Updated 5 years ago
- Descriptors-free Collective Variables From Geometric Graph Neural Networks.☆12Dec 27, 2024Updated last year
- ☆12Jul 5, 2024Updated 2 years ago
- ☆21Updated this week
- From Theory to Therapy: Reframing SBDD Model Evaluation via Practical Metrics☆10Jun 13, 2024Updated 2 years ago
- ☆10Aug 28, 2024Updated 2 years ago
- ☆41Jun 30, 2024Updated 2 years ago
- ☆13Sep 17, 2026Updated last month
- 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.
- ☆12Mar 15, 2026Updated 7 months ago
- ☆13Feb 16, 2019Updated 7 years ago
- Open-Protein is an open source pre-training platform that supports multiple protein pre-training models and downstream tasks.☆19Apr 14, 2023Updated 3 years ago
- Generative antibody language models for framework-conditioned CDR design, scoring, and preference-based alignment.☆14Oct 25, 2026Updated last week
- ☆26Jul 14, 2024Updated 2 years ago
- Source code of Venus-MAXWELL: Efficient Learning of Protein-Mutation Stability Landscapes using Protein Language Models☆31Oct 8, 2026Updated 3 weeks ago
- ☆15Mar 6, 2024Updated 2 years ago
- ☆117Oct 23, 2026Updated last week
- A curated list of papers and resources on Structure-Based Drug Design (SBDD)☆12Jun 24, 2024Updated 2 years ago
- 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.
- ☆14Mar 7, 2024Updated 2 years ago
- ☆31Oct 15, 2024Updated 2 years ago
- ☆15Oct 18, 2026Updated 2 weeks ago
- Official Repository for the Uni-Mol Series Methods☆1,176May 29, 2025Updated last year
- ☆10Aug 4, 2024Updated 2 years ago
- substructure search in large combinatorial spaces using openchemlib☆23Sep 28, 2026Updated last month
- ☆10Jul 24, 2022Updated 4 years ago