bowang-lab / AGILE
AGILE Platform: A Deep Learning-Powered Approach to Accelerate LNP Development for mRNA Delivery
☆37Updated 3 months ago
Alternatives and similar repositories for AGILE
Users that are interested in AGILE are comparing it to the libraries listed below
Sorting:
- ☆39Updated last year
- ImageMol is a molecular image-based pre-training deep learning framework for computational drug discovery.☆52Updated 2 months ago
- Implementation of ICLR23 paper "Molecule Generation for Target Protein Binding with Structural Motifs"☆66Updated last year
- [NeurIPS 2023] DrugCLIP: Contrastive Protein-Molecule Representation Learning for Virtual Screening☆83Updated last year
- A unified framework for predicting drug-target interactions, binding affinities and activation/inhibition mechanisms.☆42Updated 3 months ago
- a multi-property optimization method.☆33Updated 5 months ago
- ☆82Updated 5 months ago
- Awesome De novo drugs design papers☆87Updated last year
- ☆48Updated last year
- Incorporation of conformational space profile into molecular representation learning, and its application to drug discovery, including vi…☆50Updated last month
- A bi-directional attention neural network for compound–protein interaction and binding affinity prediction.☆30Updated 2 years ago
- PocketDTA☆29Updated 6 months ago
- Code for "MGCVAE: Multi-Objective Inverse Design via Molecular Graph Conditional Variational Autoencoder" (https://doi.org/10.1021/acs.jc…☆30Updated 6 months ago
- ☆23Updated last year
- ESM-GearNet for Protein Structure Representation Learning (https://arxiv.org/abs/2303.06275)☆95Updated last year
- Official implementation of DrugGEN: Target Specific De Novo Design of Drug Candidate Molecules with Graph Transformer-based Generative Ad…☆63Updated last month
- A novel graph neural network strategy with the Vina distance optimization terms to predict protein-ligand binding affinity☆31Updated last year
- Sequence-to-drug concept adds a perspective on drug design. It can serve as an alternative method to SBDD, particularly for proteins that…☆66Updated last year
- This repository contains the code for the work on protein-ligand interaction with GNNs and XAI☆35Updated last year
- This repo contains the codes for our paper "End-to-End Full-Atom Antibody Design"☆105Updated 2 months ago
- ☆18Updated 3 weeks ago
- Geometry Deep Learning for Drug Discovery and Life Science☆68Updated last year
- SELFormer: Molecular Representation Learning via SELFIES Language Models☆90Updated 5 months ago
- ☆124Updated 6 months ago
- This repo contains the codes for our paper Conditional Antibody Design as 3D Equivariant Graph Translation.☆95Updated 2 years ago
- Papers about Structure-based Drug Design (SBDD)☆111Updated 5 months ago
- This is The repository for Paper "AttentionSiteDTI: Attention Based Model for Predicting Drug-Target Interaction Using Graph Representati…☆43Updated last year
- ☆37Updated last year
- Working collection of papers, repos and models of transformer based language models trained or tuned for the Chemical domain, from natura…☆63Updated last year
- Official implementation for ActFound (Nature Machine Intelligence): A bioactivity foundation model using pairwise meta-learning☆42Updated 6 months ago