☆15Jun 25, 2025Updated 10 months ago
Alternatives and similar repositories for TRACER
Users that are interested in TRACER are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆32Mar 10, 2026Updated last month
- ☆13Apr 8, 2025Updated last year
- Deep Learning-based Bioisosteric Replacements for Optimization of Multiple Molecular Properties☆30Dec 3, 2025Updated 5 months ago
- ☆12Dec 2, 2022Updated 3 years ago
- Augmented Memory and Beam Enumeration implementation☆27Jun 9, 2024Updated last year
- 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.
- ☆59Feb 17, 2026Updated 2 months ago
- ☆18Sep 15, 2025Updated 7 months ago
- Experiments for the method comparison paper.☆38Oct 3, 2025Updated 7 months ago
- Fast Molecular Property Prediction with mordredcommunity☆58Dec 12, 2025Updated 4 months ago
- Code for the paper Copolymer Informatics with Multi-Task Deep Neural Networks☆14Sep 3, 2024Updated last year
- Graphical Representation of Ancestral Sequence Predictions☆13Mar 6, 2023Updated 3 years ago
- ☆29Jan 16, 2026Updated 3 months ago
- ☆52Mar 24, 2025Updated last year
- Monte Carlo Flow Models for Data Imputation☆20Jun 1, 2020Updated 5 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.
- Plugin for folding sequences directly in PyMOL☆29Aug 5, 2025Updated 9 months ago
- Official implementation of RuSH (Scaffold Hopping with Generative Reinforcement Learning). Includes ScaffoldFinder algorithm for 2D decor…☆22Feb 20, 2025Updated last year
- Partial Charge assignment for Molecular Dynamics☆23Dec 15, 2025Updated 4 months ago
- ICLR 2025 paper: 3DMolFormer: A Dual-channel Framework for Structure-based Drug Discovery☆28Apr 25, 2025Updated last year
- ☆11Jun 16, 2024Updated last year
- Sort & Slice: A Simple and Superior Alternative to Hash-Based Folding for Extended-Connectivity Fingerprints (ECFPs)☆10Feb 13, 2025Updated last year
- The official GitHub repository for the Nature Communications paper "Computational Design of Generalist Cyclopropanases with Stereodiverge…☆13Jan 23, 2026Updated 3 months ago
- a Python program for running QM/MM simulations using Q-Chem and OpenMM☆16Apr 24, 2022Updated 4 years ago
- ☆12Jul 3, 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.
- CReM-dock: generation of chemically reasonable molecules guided by molecular docking☆30Apr 26, 2026Updated last week
- Some scoring functions for predicting the effects of mutations on protein sequences using ESM-2☆11Dec 10, 2023Updated 2 years ago
- Supporting Information for "Prediction of Organic Compound Aqueous Solubility Using Interpretable Machine Learning"☆13Jun 5, 2023Updated 2 years ago
- ☆52Jan 15, 2026Updated 3 months ago
- ☆18Jan 19, 2026Updated 3 months ago
- Code Space of SynLlama☆48Apr 11, 2026Updated 3 weeks ago
- ParetoDrug☆11Sep 3, 2024Updated last year
- Utilities for working with datasets of chemical reactions, reaction templates and template extraction.☆92Apr 13, 2026Updated 3 weeks ago
- ☆41Sep 21, 2025Updated 7 months 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.
- NAMD QM/MM Tutorial on Free Energy Profile of Reaction Mechanisms☆15Sep 14, 2018Updated 7 years ago
- ☆15Sep 27, 2024Updated last year
- SpaceHASTEN: A structure-based virtual screening tool for non-enumerated virtual chemical libraries☆18Feb 12, 2026Updated 2 months ago
- ☆38Jun 4, 2024Updated last year
- Quick mapping of Uniprot sequences to PDB structures☆36Apr 1, 2025Updated last year
- BitBIRCH-Lean, a memory-efficient implementation of BitBIRCH designed for high-throughput clustering of huge molecular libraries☆116Updated this week
- ProteinDesign with RFdiffusion and ProteinMPNN/LigandMPNN☆23Mar 6, 2025Updated last year