wzn99 / DrugPilotLinks
A LLM-based Agent Framework for Drug Discovery
☆19Updated 4 months ago
Alternatives and similar repositories for DrugPilot
Users that are interested in DrugPilot are comparing it to the libraries listed below
Sorting:
- ☆23Updated last month
- ☆34Updated last year
- Autoregressive fragment-based diffusion for target-aware ligand design☆31Updated last year
- DrugGen: Advancing Drug Discovery with Large Language Models and Reinforcement Learning Feedback☆19Updated 6 months ago
- Model to predict kinase-ligand pKi values.☆12Updated 2 years ago
- A Deep Learning Framework for Allosteric Site Prediction☆14Updated 6 months ago
- ☆23Updated 6 months ago
- benchmarking AI-powered docking methods from the perspective of virtual screening☆29Updated 11 months ago
- This is the GitHub repository accompanying Krishnan, Anahtar, Valeri, et al., 2025☆33Updated 6 months ago
- AlphaDrug: Protein Target Specific De Novo Molecular Generation☆40Updated 3 years ago
- DeepCDA☆15Updated 5 years ago
- ☆20Updated 4 years ago
- ☆17Updated 5 years ago
- ☆31Updated 3 years ago
- Collection of papers for Molecular Representation using AI☆29Updated 3 weeks ago
- a method for CPI and DTA prediction☆11Updated 3 years ago
- InteractionGraphNet: a Novel and Efficient Deep Graph Representation Learning Framework for Accurate Protein-Ligand Interaction Predictio…☆32Updated 4 years ago
- Spatiotemporal identification of druggable binding sites using deep learning☆22Updated 4 years ago
- ☆12Updated 3 years ago
- Various Ideas for Protein Masked LM with ESMFold/ESM-2☆15Updated 2 years ago
- A surface-based deep learning approach for the prediction of ligand binding sites on proteins☆43Updated 2 years ago
- Code for ICML 2023 paper "Reprogramming Pretrained Language Models for Antibody Sequence Infilling"☆24Updated 2 months ago
- A Molecular Benchmark for Disease and Target Based Machine Learning☆25Updated 3 years ago
- Automatic extraction of interacting compound-target pairs from ChEMBL.☆19Updated 2 months ago
- Code and data used in https://doi.org/10.1101/2021.08.01.454656☆54Updated 3 years ago
- De novo molecular design with deep molecular generative models for protein-protein interaction(PPI) inhibitors☆20Updated last year
- NodeCoder is a general framework based on graph convolutional neural network for protein function prediction.☆34Updated last year
- RNA, mRNA, DNA, Peptide, Protein, Antibody and Complex | Folding☆38Updated 3 weeks ago
- Antibody Langauge Ensemble Fusion - fuses antibody structural ensemble and language representation for property prediction☆13Updated last year
- Code for peptide ligand design with machine learning models.☆28Updated last year