GIST-CSBL / HoTSLinks
HoTS: Sequence-based prediction of binding regions and drug-target interactions.
☆26Updated 2 years ago
Alternatives and similar repositories for HoTS
Users that are interested in HoTS are comparing it to the libraries listed below
Sorting:
- Drug-target binding affinity prediction using representation learning, graph mining, and machine learning☆24Updated 3 years ago
- A Python 3 version of the protein descriptor package propy☆42Updated 2 years ago
- PocketDTA☆30Updated 8 months ago
- NodeCoder is a general framework based on graph convolutional neural network for protein function prediction.☆33Updated last year
- Python package to atom map, correct and suggest enzymatic reactions☆38Updated last year
- HELM-GPT: de novo macrocyclic peptide design using generative pre-trained transformer☆24Updated 11 months ago
- ☆28Updated last month
- A deep learning framework for predicting interactions between protein-protein interaction targets and modulators☆14Updated last year
- ☆20Updated 3 years ago
- Antibody paratope prediction using Graph Neural Networks with minimal feature vectors☆37Updated 2 years ago
- ☆17Updated 3 years ago
- An unofficial re-implementation of AntiBERTy, an antibody-specific protein language model, in PyTorch.☆24Updated last year
- Python tool for the discovery of similar 3D structural motifs across protein structures.☆27Updated last year
- Multi-Channel Deep Chemogenomic Modeling of Receptor-Ligand Binding Affinity Prediction for Drug Discovery☆28Updated 4 years ago
- ☆33Updated last year
- ☆69Updated 4 years ago
- ☆25Updated 3 years ago
- KA-Search: Rapid and exhaustive sequence identity search of known antibodies☆22Updated 11 months ago
- Machine learning models for antibody sequences in PyTorch☆39Updated 4 years ago
- ☆49Updated last year
- The official codebase of peptidy, a peptide processing tool for machine learning.☆31Updated 2 months ago
- Pocket-Oriented Elaboration of Molecules: application to CDK8 inhibition☆14Updated 2 years ago
- Fast and accurate molecular docking with an AI pose scoring function☆40Updated last year
- DiffDock implementation that adds support for HPC execution using Slurm and Singularity☆26Updated last month
- ☆12Updated last year
- Repo contains source code of the SurfaceID paper☆23Updated last year
- COCONUT (COlleCtion of Open Natural prodUcTs): A comprehensive platform facilitating natural product research by providing data, tools, a…☆30Updated last week
- A foundation model approach to guide antimicrobial peptide design in the era of artificial intelligence driven scientific discovery☆33Updated last month
- Machine learning-driven antibody design☆58Updated last year
- Antibody Annotation - Annotate VH and VL sequences (FR and CDR) in Python☆30Updated 2 years ago