fengshikun / UniMAPLinks
☆13Updated 8 months ago
Alternatives and similar repositories for UniMAP
Users that are interested in UniMAP are comparing it to the libraries listed below
Sorting:
- Implementation of ICLR23 paper "Molecule Generation for Target Protein Binding with Structural Motifs"☆68Updated last year
- [ICML 2024] Interaction-based Retrieval-augmented Diffusion Models for Protein-specific 3D Molecule Generation☆30Updated 10 months ago
- [ICLR 2023] "Mole-BERT: Rethinking Pre-training Graph Neural Networks for Molecules"☆120Updated 2 years ago
- [NeurIPS 2023] DrugCLIP: Contrastive Protein-Molecule Representation Learning for Virtual Screening☆98Updated last year
- ☆11Updated 4 years ago
- [ICLR 2024] Protein-Ligand Interaction Prior for Binding-aware 3D Molecule Diffusion Models☆46Updated 10 months ago
- The implementation of the paper "Multi-Modal Representation Learning for Molecular Property Prediction: Sequence, Graph, Geometry".☆43Updated 6 months ago
- [BIB 2023] Official implementation of "R2-DDI: Relation-aware Feature Refinement for Drug-drug Interaction Prediction".☆13Updated last year
- Llamole: Multimodal Large Language Models for Inverse Molecular Design with Retrosynthetic Planning☆28Updated 9 months ago
- Code for AAAI 2024 paper "PSC-CPI: Multi-Scale Protein Sequence-Structure Contrasting for Efficient and Generalizable Compound-Protein In…☆28Updated 5 months ago
- SSM-DTA: Breaking the Barriers of Data Scarcity in Drug-Target Affinity Prediction (Briefings in Bioinformatics 2023)☆52Updated last year
- ☆64Updated last month
- ☆47Updated 2 years ago
- A Multi-modal Large Language Model for Molecular Science with Graph, Image, and Text☆30Updated last month
- Code for ICML 2024 paper "Learning to Predict Mutational Effects of Protein-Protein Interactions by Microenvironment-aware Hierarchical P…☆41Updated 9 months ago
- ☆23Updated 5 months ago
- [ICLR 2024] Domain-Agnostic Molecular Generation with Chemical Feedback☆169Updated 6 months ago
- Papers about Structure-based Drug Design (SBDD)☆118Updated 7 months ago
- Implementation of GTMGC: Using Graph Transformer to Predict Molecule’s Ground-State Conformation (ICLR2024 Spotlight).☆17Updated last year
- Official repository for MolCRAFT series☆100Updated this week
- Towards Explainable Target-Aware Molecule Generation with Knowledge Guidance☆32Updated last year
- Official implementation for AAAI 2022 paper: "GeomGCL: Geometric Graph Contrastive Learning for Molecular Property Prediction".☆22Updated 3 years ago
- The PyTorch implementation of MoMu, described in "Natural Language-informed Modeling of Molecule Graphs".☆28Updated last year
- GeoSSL: Molecular Geometry Pretraining with SE(3)-Invariant Denoising Distance Matching, ICLR'23 (https://openreview.net/forum?id=CjTHVo1…☆46Updated last year
- ☆50Updated last year
- [Nat. Comm. 2024] Multimodal learning for chemical domain, with SMILES and properties.☆40Updated 6 months ago
- Implementation of ICML23 paper "Learning Subpocket Prototypes for Generalizable Structure-based Drug Design"☆29Updated last year
- The official implementation of dual-view molecule pre-training.☆42Updated 3 years ago
- 3D_Molecular_Generation☆96Updated 7 months ago
- ☆133Updated 8 months ago