☆47Mar 11, 2024Updated 2 years ago
Alternatives and similar repositories for awesome-molecule-protein-pretrain-papers
Users that are interested in awesome-molecule-protein-pretrain-papers are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- A deep learning framework for predicting interactions between protein-protein interaction targets and modulators☆15Dec 2, 2023Updated 2 years ago
- [IJCAI 2023 survey track]A curated list of resources for chemical pre-trained models☆541Jun 17, 2023Updated 3 years ago
- GeoSSL: Molecular Geometry Pretraining with SE(3)-Invariant Denoising Distance Matching, ICLR'23 (https://openreview.net/forum?id=CjTHVo1…☆49Jul 27, 2023Updated 2 years ago
- Awesome Protein Representation Learning☆687Nov 16, 2024Updated last year
- Times Square Sampling☆13Feb 24, 2023Updated 3 years ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- ☆78Feb 11, 2025Updated last year
- Papers about Structure-based Drug Design (SBDD)☆153Sep 1, 2025Updated 10 months ago
- Graphical User Interface to control a potentiostat☆15Mar 27, 2023Updated 3 years ago
- Official implementation of pre-training via denoising for TorchMD-NET☆99Mar 2, 2023Updated 3 years ago
- ☆11May 27, 2022Updated 4 years ago
- Official repository for MolCRAFT series☆157Oct 27, 2025Updated 8 months ago
- Graph Neural Networks to predict the cosmological parameters or the galaxy power spectrum from galaxy catalogs.☆20Jan 23, 2023Updated 3 years ago
- The official implementation of DecompDiff: Diffusion Models with Decomposed Priors for Structure-Based Drug Design (ICML 2023)☆73Jul 27, 2023Updated 2 years ago
- ☆10Jun 10, 2024Updated 2 years 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.
- POLYGON VAE For de novo Polypharmacology☆43Mar 5, 2025Updated last year
- ESM-driven Pocket Cross Similarity☆17Aug 11, 2025Updated 11 months ago
- ☆13Jul 2, 2025Updated last year
- The first GANs-based omics-to-omics translation framework☆15Sep 5, 2023Updated 2 years ago
- Official repo for "Binary Retrieval-augmented Reward Mitigates Hallucinations"☆15Nov 13, 2025Updated 8 months ago
- The official implementation of 3D Equivariant Diffusion for Target-Aware Molecule Generation and Affinity Prediction (ICLR 2023)☆344Jan 10, 2024Updated 2 years ago
- Scorpius: Poisoning scientific knowledge using large language models☆11Aug 3, 2024Updated last year
- notebook repository☆13Jan 17, 2022Updated 4 years ago
- ☆505Jul 15, 2026Updated last week
- 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.
- HOLMES: Health OnLine Model Ensemble Serving for Deep Learning Models in Intensive Care Units (KDD 2020)☆12Jan 25, 2021Updated 5 years ago
- Gromacs Implementation of OPLS-AAM Force field☆15Aug 5, 2018Updated 7 years ago
- ☆27Apr 26, 2023Updated 3 years ago
- Contrastive learning and pre-trained encoder (CLAPE) for protein-small molecules binding (SMB) sites prediction☆19Aug 22, 2024Updated last year
- Overview of published generative models that produce molecules☆16Jan 16, 2020Updated 6 years ago
- Official Repository for the Uni-Mol Series Methods☆1,133May 29, 2025Updated last year
- Code and documentation for QSAR modeling and virtual screening of small molecule TMPRSS2 inhibitors☆10Sep 16, 2020Updated 5 years ago
- ☆12Feb 14, 2024Updated 2 years ago
- Genome annotation pre-publication results☆36Jun 19, 2026Updated last month
- Bare Metal GPUs on DigitalOcean Gradient AI • AdPurpose-built for serious AI teams training foundational models, running large-scale inference, and pushing the boundaries of what's possible.
- Algorithms for various Network Layouts and Tooling for planning FE Calculations☆24Jul 7, 2026Updated 2 weeks ago
- Python package for AAIndex databases (https://www.genome.jp/aaindex/)☆14Jul 1, 2026Updated 2 weeks ago
- Contextual AI models for single-cell protein biology☆109May 7, 2026Updated 2 months ago
- ☆27Apr 15, 2025Updated last year
- scDiff: A General Single-Cell Analysis Framework via Conditional Diffusion Generative Models☆34Aug 13, 2024Updated last year
- A curated list of papers related to molecular diffusion models.☆106Apr 10, 2026Updated 3 months ago
- Cross-modal generation of molecules from gene expression inputs. (Briefings in Bioinformatics 2024)☆11May 3, 2025Updated last year