KyleBae1017's Stars
lsh0520/3D-MoLM
cambridge-mlg/weighted-retraining
gersteinlab/MolLM
A Unified Language Model to Integrate Biomedical Text with 2D and 3D Molecular Representations
datamol-io/molfeat
molfeat - the hub for all your molecular featurizers
graphcore-research/minimol
MiniMol is a 10M-parameters molecular fingerprinting model pre-trained on >3300 biological and quantum tasks
chao1224/MoleculeSTM
Multi-modal Molecule Structure-text Model for Text-based Editing and Retrieval, Nat Mach Intell 2023 (https://www.nature.com/articles/s42256-023-00759-6)
openclimatefix/graph_weather
PyTorch implementation of Ryan Keisler's 2022 "Forecasting Global Weather with Graph Neural Networks" paper (https://arxiv.org/abs/2202.07575)
microsoft/ClimaX
Foundation model for weather & climate
enkeejunior1/Diffusion-Pullback
Official Implementation of understanding the latent space of diffusion models through the lens of riemannian geometry (NeurIPS 2023)
WisconsinAIVision/ViP-LLaVA
[CVPR2024] ViP-LLaVA: Making Large Multimodal Models Understand Arbitrary Visual Prompts
elenacliu/pytorch_cuda_driver_compatibilities
Quick check of compatible versions of PyTorch, Python, CUDA, cuDNN, NVIDIA driver! 实现 PyTorch, Python, CUDA, cuDNN, NVIDIA driver 兼容版本速查!
awslabs/dgl-lifesci
Python package for graph neural networks in chemistry and biology
nataliemaus/lolbo
mlvlab/ProMetaR
Official implementation of CVPR 2024 paper "Prompt Learning via Meta-Regularization".
learningmatter-mit/geom
GEOM: Energy-annotated molecular conformations
datamol-io/datamol
Molecular Processing Made Easy.
sheldonresearch/ProG
A Unified Python Library for Graph Prompting
azminewasi/Awesome-Graph-Research-ICML2024
All graph/GNN papers accepted at the International Conference on Machine Learning (ICML) 2024.
phenixace/MolReGPT
syr-cn/ReactXT
[ACL 2024] ReactXT: Understanding Molecular “Reaction-ship” via Reaction-Contextualized Molecule-Text Pretraining. by Zhiyuan Liu*, Yaorui Shi*, An Zhang, Sihang Li, Enzhi Zhang, Xiang Wang, Kenji Kawaguchi, Tat-Seng Chua
IDEA-XL/MoleculeQA
The largest existing Question Answering Dataset for molecular research.
Deno-V/tgm-dlm
Code for AAAI24 paper Text-Guided Molecule Generation with Diffusion Language Model
ardigen/MAT
The official implementation of the Molecule Attention Transformer.
showlab/Awesome-MLLM-Hallucination
📖 A curated list of resources dedicated to hallucination of multimodal large language models (MLLM).
QizhiPei/FABind
FABind: Fast and Accurate Protein-Ligand Binding (NeurIPS 2023)
kexinhuang12345/MolTrans
MolTrans: Molecular Interaction Transformer for Drug Target Interaction Prediction (Bioinformatics)
naver-ai/egtr
[CVPR 2024 Best paper award candidate] EGTR: Extracting Graph from Transformer for Scene Graph Generation
TaicaiChen/PG-LBO
[AAAI2024]PG-LBO: Enhancing High-Dimensional Bayesian Optimization with Pseudo-Label and Gaussian Process Guidance
mkusner/grammarVAE
Code for the "Grammar Variational Autoencoder" https://arxiv.org/abs/1703.01925
VITA-Group/LLaGA
[ICML2024] "LLaGA: Large Language and Graph Assistant", Runjin Chen, Tong Zhao, Ajay Jaiswal, Neil Shah, Zhangyang Wang