A deep-learning-based multiple toolkits (DeTool) approach that uses the inputs of enzymes and substrates for biocatalystic tasks.
☆14Nov 24, 2023Updated 2 years ago
Alternatives and similar repositories for ALDELE
Users that are interested in ALDELE are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆14Dec 28, 2025Updated 10 months ago
- Adaptive resampling for machine learning in single-cell biology☆14Sep 30, 2026Updated last month
- ☆43Aug 19, 2024Updated 2 years ago
- ☆12Jun 3, 2025Updated last year
- Predict protein thermostability with ML☆21Aug 20, 2024Updated 2 years ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- ☆14Oct 23, 2024Updated 2 years ago
- Official repository of GENzyme☆66Nov 29, 2024Updated last year
- Enzyme Activity Prediction of Sequence Variants onNovel Substrates using Improved Substrate Encodings and Convolutional Pooling☆18Nov 28, 2022Updated 3 years ago
- Python code and jupyter notebooks to accompany the manuscript "Deep learning models for lipid-nanoparticle-based drug delivery"☆14Jul 28, 2020Updated 6 years ago
- BigSMILES☆11Jun 16, 2024Updated 2 years ago
- Deep learning based prediction of temperature dependent enzyme turnover rates☆18Nov 24, 2024Updated last year
- ☆12Mar 18, 2024Updated 2 years ago
- The Block Copolymer Phase Behavior Database (BCDB)☆21Mar 1, 2024Updated 2 years ago
- TISIGNER: Unleash the power of synthetic biology☆26Aug 19, 2026Updated 2 months ago
- Serverless GPU API endpoints on Runpod - Get Bonus Credits • AdSkip the infrastructure headaches. Auto-scaling, pay-as-you-go, no-ops approach lets you focus on innovating your application.
- Transductive Active Learning with Application to Safe Bayesian Optimization☆11Mar 5, 2025Updated last year
- IntelliGenes: AI/ML pipeline for predictive analyses using multi-genomic profiles.☆17Sep 4, 2024Updated 2 years ago
- Automated BigSMILES conversion workflow and dataset for homopolymeric macromolecules☆21Jun 9, 2024Updated 2 years ago
- Well-trained models and generative outcomes for the paper "Benchmarking Study of Deep Generative Models for Inverse Polymer Design"☆12Aug 8, 2025Updated last year
- Framework to evaluate UMLFFs on experimental data☆17Jul 25, 2026Updated 3 months ago
- Lightweight toolkit for de novo molecular generation: SMILES & SELFIES tokenizers, CharRNN / MolGPT / VAE models, training, sampling, and…☆16Jul 11, 2026Updated 3 months ago
- ☆13Feb 28, 2026Updated 8 months ago
- Automated input file creation for quantum chemical studies of embedded proteins☆12Sep 18, 2025Updated last year
- A curated list of awesome protein design research, software and resources.☆17May 10, 2022Updated 4 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- ☆10Jan 15, 2025Updated last year
- Large language models, physics-based modeling, experimental measurements: the trinity of data-scarce learning of polymer properties☆15Sep 4, 2025Updated last year
- An Interface-Predicting Language Model for Designing Peptide-Guided Protein Degraders☆18Sep 10, 2024Updated 2 years ago
- Data enhancement scheme for addressing the dilemma of small data on machine learning for polymer.☆13Apr 26, 2024Updated 2 years ago
- Q6 Repository -- EVB, FEP and LIE simulator.☆35Nov 7, 2023Updated 2 years ago
- ☆103Jul 24, 2026Updated 3 months ago
- Plugin for folding sequences directly in PyMOL☆29Aug 5, 2025Updated last year
- ☆15Jul 5, 2022Updated 4 years ago
- Clustering of SES virtual probes for pocket generation and ranking via Isolation Forest☆14Mar 22, 2023Updated 3 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.
- ☆12May 28, 2024Updated 2 years ago
- A toolkit for enzyme discovery☆30May 18, 2026Updated 5 months ago
- Quantifying Pairwise Chemical Similarity for Polymers☆16Jan 23, 2024Updated 2 years ago
- A package to create, visualize, and analysis PDB-derived pseudo-ensembles.☆12Jan 7, 2026Updated 9 months ago
- A refined evaluation pipeline for 3D molecular generative models trained on GEOM-Drugs.☆16Sep 10, 2025Updated last year
- Speedrunning PLM pretraining☆14Sep 22, 2026Updated last month
- Representation learning for protein functional site analysis☆17Aug 11, 2023Updated 3 years ago