☆43Apr 21, 2022Updated 4 years ago
Alternatives and similar repositories for SBMolGen
Users that are interested in SBMolGen are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Automatic Fragment Linking with Deep Conditional Transformer Neural Networks☆56Feb 27, 2022Updated 4 years ago
- ☆26Dec 4, 2019Updated 6 years ago
- ☆66Mar 11, 2023Updated 3 years ago
- ☆22Sep 24, 2022Updated 3 years ago
- A SMILES-based encoder-decoder architecture for molecular scaffold decoration☆83May 8, 2020Updated 5 years ago
- AI Agents on DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- Speed virtual screening by 50X☆100Mar 24, 2023Updated 3 years ago
- Systemic Evolutionary Chemical Space Exploration for Drug Discovery☆92Sep 2, 2025Updated 8 months ago
- RDKit code for the JCIM article☆17Aug 17, 2013Updated 12 years ago
- ☆11Oct 1, 2021Updated 4 years ago
- Molecular SMILE generation with recurrent neural networks☆21Jul 13, 2025Updated 9 months ago
- ☆373May 24, 2025Updated 11 months ago
- Tensorflow implementation of Generating Focussed Molecule Libraries for Drug Discovery with Recurrent Neural Networks☆29Feb 4, 2019Updated 7 years ago
- Novel molecules from a reference shape!☆82Jan 30, 2024Updated 2 years ago
- Molecular vectorization and batch generation☆50Mar 23, 2021Updated 5 years ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- AI-powered Virtual Screening☆88Jun 23, 2023Updated 2 years ago
- ☆11Apr 22, 2024Updated 2 years ago
- ☆42Mar 26, 2025Updated last year
- ☆14Jul 5, 2022Updated 3 years ago
- Snippets for common computer-aided drug design tasks☆10Oct 17, 2017Updated 8 years ago
- ☆25Mar 11, 2022Updated 4 years ago
- ☆28Mar 16, 2023Updated 3 years ago
- Dock Multiple Ligands with AutoDock Vina with one Command☆11Jan 10, 2018Updated 8 years ago
- ☆13Sep 8, 2021Updated 4 years ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- An implementation of the Solubility Forecast Index (SFI)☆24Oct 6, 2025Updated 6 months ago
- ☆178Apr 22, 2022Updated 4 years ago
- Generate images of molecules and their properties for use in presentations and reports☆44Jul 21, 2022Updated 3 years ago
- graph generative model for molecule☆42Dec 17, 2019Updated 6 years ago
- ☆65Oct 24, 2018Updated 7 years ago
- Kinase-focused fragment library☆69Jan 28, 2026Updated 3 months ago
- Code for "Multi-Objective De Novo Drug Design with Conditional Graph Generative Model" (https://arxiv.org/abs/1801.07299)☆138Dec 7, 2018Updated 7 years ago
- Supporting Information of Publications☆14Mar 24, 2019Updated 7 years ago
- Lamarckian Evolutionary Algorithm for de novo Drug Design☆27Mar 3, 2023Updated 3 years ago
- GPUs on demand by Runpod - Special Offer Available • AdRun AI, ML, and HPC workloads on powerful cloud GPUs—without limits or wasted spend. Deploy GPUs in under a minute and pay by the second.
- A parallel molecular docking program based on AutoDock Vina☆19Sep 29, 2025Updated 7 months ago
- Refined and extended version of ChemTS☆121Apr 5, 2026Updated 3 weeks ago
- AlphaDrug: Protein Target Specific De Novo Molecular Generation☆41Oct 20, 2022Updated 3 years ago
- Source code and data files for "PEMT: A patent enrichment tool with applicability in drug discovery"☆16Jan 27, 2025Updated last year
- Updated version of Silicos-it's pharmacophore-based alignment tool (Align-it)☆14Jan 26, 2022Updated 4 years ago
- Supporting code for the paper "Bidirectional Molecule Generation with Recurrent Neural Networks" (J. Chem. Inf. 2020, 60, 3).☆52Jun 3, 2020Updated 5 years ago
- PROTACable is an end-to-end in-silico design toolkit for novel PROTACs☆29Jun 3, 2024Updated last year