GenUI frontend application. It provides a GUI to the GenUI REST API web services.
☆23Sep 4, 2023Updated 2 years ago
Alternatives and similar repositories for genui-gui
Users that are interested in genui-gui are comparing it to the libraries listed below
Sorting:
- The backend services of the GenUI framework. The backend provides the REST API used for molecular generation, QSAR modelling and chemical…☆36Feb 3, 2026Updated last month
- ☆13Sep 4, 2021Updated 4 years ago
- ☆23Jul 27, 2021Updated 4 years ago
- Lamarckian Evolutionary Algorithm for de novo Drug Design☆27Mar 3, 2023Updated 3 years ago
- HELM-GPT: de novo macrocyclic peptide design using generative pre-trained transformer☆31Jul 4, 2024Updated last year
- Deep Binding Structure RMSD Prediction☆22Mar 19, 2021Updated 4 years ago
- AnnapuRNA: a scoring function for predicting RNA-small molecule interactions.☆21Apr 5, 2024Updated last year
- Paper for release☆11Sep 24, 2021Updated 4 years ago
- ☆28Feb 22, 2026Updated last week
- Optimization of binding affinities in chemical space for drug discovery☆36Jan 31, 2023Updated 3 years ago
- ☆12Oct 9, 2024Updated last year
- Learning Protein-Ligand Properties with Atomic Environment Vectors☆10Apr 19, 2024Updated last year
- Peptide Virtual Screening Pipeline☆14Jul 3, 2019Updated 6 years ago
- EViS: an Enhanced Virtual Screening Approach based on Pocket Ligand Similarity☆14Dec 7, 2021Updated 4 years ago
- ☆28Mar 16, 2023Updated 2 years ago
- An Integrative Drug Repurposing Pipeline using KNIME and Programmatic Data Access: A case study on COVID-19 Data☆15Sep 29, 2020Updated 5 years ago
- ☆11Oct 1, 2021Updated 4 years ago
- ☆14Jul 5, 2022Updated 3 years ago
- ☆26Dec 4, 2019Updated 6 years ago
- A versatile workflow for the generation of receptor-based pharmacophore models for virtual screening☆32May 22, 2025Updated 9 months ago
- LigTMap currently supports prediction for 17 protein target classes that include 6000+ protein targets.☆16Feb 20, 2021Updated 5 years ago
- ☆17Mar 11, 2023Updated 2 years ago
- Code for "De novo molecular design with chemical language models"☆13Nov 10, 2021Updated 4 years ago
- ☆14Jul 6, 2023Updated 2 years ago
- Extended Connectivity Interaction Features☆31Sep 23, 2021Updated 4 years ago
- ☆49Oct 8, 2020Updated 5 years ago
- Fully automated docking pipeline (can be run in distributed environments)☆55Feb 25, 2026Updated last week
- ☆17Mar 23, 2021Updated 4 years ago
- Multiobjective De Novo Drug Design with Recurrent Neural Networks and Nondominated Sorting☆18Jan 20, 2020Updated 6 years ago
- MEGADOCK on Google Colaboratory☆20Oct 2, 2023Updated 2 years ago
- ☆16Aug 14, 2019Updated 6 years ago
- De Novo Drug Design with RNNs and Transformers☆172Feb 19, 2026Updated 2 weeks ago
- StarGazer is a tool designed for rapidly assessing drug repositioning opportunities. It combines multi-source, multi-omics data with a no…☆35Aug 14, 2023Updated 2 years ago
- ☆32Mar 19, 2023Updated 2 years ago
- ☆62Sep 18, 2025Updated 5 months ago
- Improved Scaffold Hopping in Ligand-based Virtual Screening Using Neural Representation Learning☆21Mar 9, 2021Updated 4 years ago
- chemmodlab: A Cheminformatics Modeling Laboratory for Fitting and Assessing Machine Learning Models☆17Nov 20, 2025Updated 3 months ago
- Statistical Analysis of Docking Results and Scoring functions☆21Feb 22, 2026Updated last week
- A repo for analysis of ensembles of protein-ligand complexes☆30Jan 22, 2026Updated last month