☆46Oct 17, 2023Updated 3 years ago
Alternatives and similar repositories for MPG
Users that are interested in MPG are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆23Feb 22, 2024Updated 2 years ago
- ☆12Jun 19, 2021Updated 5 years ago
- A deep learning solvation model☆13Aug 24, 2021Updated 5 years ago
- MSA-Regularized Protein Sequence Transformer toward Predicting Genome-Wide Chemical-Protein Interactions: Application to GPCRome Deorphan…☆11Oct 16, 2022Updated 4 years ago
- ☆14Jun 16, 2020Updated 6 years ago
- Simple, predictable pricing with DigitalOcean hosting • AdAlways know what you'll pay with monthly caps and flat pricing. Enterprise-grade infrastructure trusted by 600k+ customers.
- Code for Single-step Retrosynthesis model Retroprime☆40Apr 27, 2021Updated 5 years ago
- The code for SAG-DTA: Prediction of Drug–Target Affinity Using Self-Attention Graph Network.☆12Dec 27, 2021Updated 4 years ago
- This repository provides an implementation of the DTiGEMSplus tool, a network-based method for computational Drug-Target Interaction pred…☆27Sep 28, 2021Updated 5 years ago
- ☆13May 21, 2024Updated 2 years ago
- Code for paper "TrimNet: learning molecular representation from triplet messages for biomedicine "☆59Jun 29, 2023Updated 3 years ago
- Auto-regressive causal language model for molecule (SMILES) and reaction template (SMARTS) generation based on the Hugging Face implement…☆20Jun 1, 2024Updated 2 years ago
- This repository provides an implementation of the DTi2Vec tool, to identify Drug-Target interaction using network embedding and ensemble …☆12Sep 28, 2021Updated 5 years ago
- MGA☆44Jan 15, 2021Updated 5 years ago
- ☆45Aug 28, 2022Updated 4 years ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- Python wrapper for OSRA. Supports R-Group logic and integration with ChemSchematicResolver☆10Apr 4, 2020Updated 6 years ago
- Shape-based alignment of molecules using 3D point-based representation☆26Apr 8, 2026Updated 7 months ago
- Implementation of AEMDA for inferring potential disease-miRNA associations.☆13Apr 13, 2021Updated 5 years ago
- ☆12Nov 11, 2019Updated 6 years ago
- A python package for computer-aid drug design.☆43Nov 21, 2025Updated 11 months ago
- Drug-target interaction prediction using deepWalk node embedding algorithm on drugBank☆11Nov 8, 2020Updated 6 years ago
- Source code and data files for manuscript titled "Pharmaceutical patent landscaping: A novel approach to understand patents from the drug…☆15Nov 27, 2023Updated 2 years ago
- ☆16Jan 1, 2020Updated 6 years ago
- ☆13Feb 24, 2021Updated 5 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.
- Code for "HiGNN: A Hierarchical Informative Graph Neural Network for Molecular Property Prediction Equipped with Feature-Wise Attention"☆55Dec 16, 2022Updated 3 years ago
- research the 2019-nCov and design the inhibitors with AI☆14Jun 6, 2022Updated 4 years ago
- Active learning☆28Dec 17, 2020Updated 5 years ago
- ☆38Oct 8, 2021Updated 5 years ago
- ☆35Nov 24, 2020Updated 5 years ago
- DTI prediction method☆24Jan 22, 2024Updated 2 years ago
- The code for "SE-GSL: A General and Effective Graph Structure Learning Framework through Structural Entropy Optimization"☆15Mar 10, 2023Updated 3 years ago
- ☆71Mar 13, 2023Updated 3 years ago
- ☆16Oct 28, 2024Updated 2 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.
- Code for Molformer (AAAI 2023)☆96Jun 14, 2025Updated last year
- Making self-supervised learning work on molecules by using their 3D geometry to pre-train GNNs. Implemented in DGL and Pytorch Geometric.☆171Oct 8, 2023Updated 3 years ago
- ☆13Oct 21, 2018Updated 8 years ago
- ☆77Sep 19, 2022Updated 4 years ago
- This repository contains a PyTorch implementation of the paper "Hierarchical Graph Representation Learning for the Prediction of Drug-Tar…☆14Jul 21, 2022Updated 4 years ago
- Implementation of GCNH, a GNN for heterophilous graphs described in the paper "GCNH: A Simple Method For Representation Learning On Heter…☆12Apr 27, 2023Updated 3 years ago
- MolMapNet: An Efficient ConvNet with Knowledge-based Molecular Represenations for Molecular Deep Learning☆146Apr 8, 2026Updated 7 months ago
Are these results useful?