fengshikun / UniGEMLinks
☆21Updated 4 months ago
Alternatives and similar repositories for UniGEM
Users that are interested in UniGEM are comparing it to the libraries listed below
Sorting:
- MDM☆55Updated last year
- The code for "Graph Diffusion Transformer for Multi-Conditional Molecular Generation"☆80Updated 2 months ago
- MolDiff: Addressing the Atom-Bond Inconsistency Problem in 3D Molecule Diffusion Generation☆65Updated last year
- [AAAI 2023] The implementation for the paper "Energy-Motivated Equivariant Pretraining for 3D Molecular Graphs"☆34Updated 10 months ago
- ☆17Updated last year
- GeoSSL: Molecular Geometry Pretraining with SE(3)-Invariant Denoising Distance Matching, ICLR'23 (https://openreview.net/forum?id=CjTHVo1…☆47Updated 2 years ago
- This is the official implementation of the paper: Fractional Denoising for 3D Molecular Pre-training☆21Updated last year
- Official implementation of pre-training via denoising for TorchMD-NET☆96Updated 2 years ago
- [ICLR 2024] Protein-Ligand Interaction Prior for Binding-aware 3D Molecule Diffusion Models☆49Updated 11 months ago
- ☆20Updated last month
- Implementation of ICML2023 paper : Coarse-to-Fine: a Hierarchical Diffusion Model for Molecule Generation in 3D☆48Updated 2 years ago
- [COLING 2025]A curated paper list about LLMs for chemistry☆86Updated this week
- ☆59Updated 8 months ago
- A Group Symmetric Stochastic Differential Equation Model for Molecule Multi-modal Pretraining, ICML'23☆33Updated last year
- Geom3D: Geometric Modeling on 3D Structures, NeurIPS 2023☆122Updated last year
- A Multi-modal Large Language Model for Molecular Science with Graph, Image, and Text☆30Updated 2 months ago
- ☆48Updated 3 years ago
- ☆96Updated last month
- ☆23Updated 6 months ago
- NeurIPS24: Aligning Target-Aware Molecule Diffusion Models with Exact Energy Optimization☆38Updated 4 months ago
- The implementation of the paper "Multi-Modal Representation Learning for Molecular Property Prediction: Sequence, Graph, Geometry".☆43Updated 7 months ago
- Code for generation and benchmarks of the Multimodal Spectroscopic Dataset☆44Updated last month
- Learning Joint 2D & 3D Diffusion Models for Complete Molecule Generation☆49Updated last year
- Official repository for MolCRAFT series☆107Updated 3 weeks ago
- [NeurIPS 2023] "Understanding the Limitations of Deep Models for Molecular Property Prediction: Insights and Solutions"☆11Updated last year
- Official implementation of HEGNN, a novel high-degree equivariant graph neural network proposed in the NeurIPS 2024 paper 'Are High-Degre…☆21Updated 9 months ago
- [ICML 2024] Interaction-based Retrieval-augmented Diffusion Models for Protein-specific 3D Molecule Generation☆31Updated 11 months ago
- An object-aware diffusion model for generating chemical reactions☆134Updated last year
- ☆58Updated 2 years ago
- Molecular Hypergraph Neural Network☆38Updated last month