Generative Tensorial Reinforcement Learning (GENTRL) model
☆12Oct 25, 2019Updated 7 years ago
Alternatives and similar repositories for GENTRL
Users that are interested in GENTRL are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- The Rosetta Bio-macromolecule modeling package.☆12Jul 9, 2025Updated last year
- Notebooks and files from the paper De novo Design and Bioactivity Prediction of SARS-CoV-2 Main Protease Inhibitors using Recurrent Neura…☆14Jan 13, 2023Updated 3 years ago
- Drug effect prediction using neural network☆25Sep 14, 2020Updated 6 years ago
- Generative Tensorial Reinforcement Learning (GENTRL) model☆642Jul 25, 2024Updated 2 years ago
- Code for "De novo molecular design with chemical language models"☆17Nov 10, 2021Updated 4 years ago
- End-to-end encrypted cloud storage - Proton Drive • AdSpecial offer: 40% Off Yearly / 80% Off First Month. Protect your most important files, photos, and documents from prying eyes.
- Code pipeline for the PaccMann^RL in iScience: https://www.cell.com/iscience/fulltext/S2589-0042(21)00237-6☆34Feb 10, 2022Updated 4 years ago
- Implementation of the paper - Generative Recurrent Networks for De Novo Drug Design.☆118Dec 26, 2022Updated 3 years ago
- EViS: an Enhanced Virtual Screening Approach based on Pocket Ligand Similarity☆14Dec 7, 2021Updated 4 years ago
- Peptide Virtual Screening Pipeline☆14Jul 3, 2019Updated 7 years ago
- Forkwell Coronavirus Hack: Drug Discovery☆12Feb 4, 2022Updated 4 years ago
- A python 2D football simulation☆18Aug 25, 2024Updated 2 years ago
- VAE for generating valid SMILES molecules☆15Oct 1, 2021Updated 5 years ago
- Heuristic energy-based cyclic peptide design☆17Feb 21, 2025Updated last year
- Code for memory-assisted reinforcement learning☆24Oct 19, 2020Updated 6 years ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- Mol-CycleGAN - a generative model for molecular optimization☆76Feb 6, 2019Updated 7 years ago
- Extract data points from chart images using machine learning - Jupyter Notebook☆18Apr 3, 2026Updated 7 months ago
- Code for the paper "JANUS: Parallel Tempered Genetic Algorithm Guided by Deep Neural Networks for Inverse Molecular Design"☆94Jul 27, 2022Updated 4 years ago
- ☆29Mar 16, 2023Updated 3 years ago
- Repository for MoleGuLAR: Molecule generation using Reinforcement Learning and Alternating Rewards☆26May 18, 2024Updated 2 years ago
- Explaining the genetic causality for complex diseases by deep association kernel learning☆15May 7, 2021Updated 5 years ago
- COVID-19 Drug Design using Generative RNN-LSTM☆14Sep 14, 2020Updated 6 years ago
- ☆25Apr 17, 2026Updated 6 months ago
- Collaborative filtering recommendation system using individual user ratings data to recommend new items for individual users.☆18May 25, 2020Updated 6 years ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- Supporting code for the paper «Leveraging molecular structure and bioactivity with chemical language models for drug design»☆12Feb 22, 2022Updated 4 years ago
- ☆102Apr 28, 2020Updated 6 years ago
- 📊 An interactive Google Sheet explorer for Jupyter & Colab. (From Arabic 'Jadwal' meaning Table).☆11Dec 28, 2025Updated 10 months ago
- Semi-supervised Junction Tree Variational Autoencoder for jointly trained property prediction and molecule structure generation. (AAAI 23…☆12Jan 14, 2023Updated 3 years ago
- Generation of new putative Mdmx inhibitors from scratch based on Recurrent Neural Networks and molecular docking.☆11Jun 27, 2019Updated 7 years ago
- Sample project to demonstrate Tesseract OCR☆13Mar 5, 2021Updated 5 years ago
- Deep Motif (ICLR16)/ Deep Motif Dashboard (PSB17): Visualizing Genomic Sequence Classifications☆46Apr 19, 2019Updated 7 years ago
- Useful Collective Variables for OpenMM☆23Oct 21, 2026Updated 2 weeks ago
- ☆11Jun 13, 2023Updated 3 years ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- GenUI frontend application. It provides a GUI to the GenUI REST API web services.☆23Sep 4, 2023Updated 3 years ago
- A coronavirus statistics, news and aid app to help navigate your way through the pandemic. 🚀☆28Dec 5, 2021Updated 4 years ago
- MXene Database. Contains structural and bandgap data for over 4000 MXene structures.☆16Apr 20, 2026Updated 6 months ago
- ☆15Nov 28, 2022Updated 3 years ago
- source code for deppHop☆36Aug 19, 2022Updated 4 years ago
- This repository contains code for the paper: Beyond Generative Models: Superfast Traversal, Optimization, Novelty, Exploration and Discov…☆136Aug 13, 2024Updated 2 years ago
- Supporting Information of Publications☆14Mar 24, 2019Updated 7 years ago