401.luoyunan / DTINet
A Network Integration Approach for Drug-Target Interaction Prediction
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401–452 of 452 by Attention Score · Oct 6, 2026 – Nov 4, 2026 (UTC)
A Network Integration Approach for Drug-Target Interaction Prediction
Wrapper for RDKit's RunReactants to improve stereochemistry handling
MOGONET (Multi-Omics Graph cOnvolutional NETworks) is a novel multi-omics data integrative analysis framework for classification tasks in biomedical applications.
The implementation code for "DAGAN: Deep De-Aliasing Generative Adversarial Networks for Fast Compressed Sensing MRI Reconstruction"
ChemML is a machine learning and informatics program suite for the chemical and materials sciences.
An automatic code generator for nonlinear model predictive control (NMPC) and the continuation/GMRES method (C/GMRES) based numerical solvers for NMPC
Go package for calculating the sunrise and sunset times for a given location
The repository host gives no description.
A script to run structural alerts using the RDKit and ChEMBL
Open-source software for exploring and analyzing large, high-dimensional image-derived data.
An ESP32 and 4.2" ePaper Display reads Dark Sky weather API and displays the weather using ESP-IDF
A framework for high-performance domain decomposition methods.
The source code for the Menge crowd simulation framework
A library of mechanised undecidability proofs in the Coq proof assistant.
The repository host gives no description.
Auto-QChem is an automated workflow for the generation and storage of DFT calculations for organic molecules.
Inner ear models for Python
code to run sei and obtain sei and sequence class predictions
Coq Repository at Nijmegen [maintainers=@spitters,@VincentSe,@Lysxia]
PRnet is a flexible and scalable perturbation-conditioned generative model predicting transcriptional responses to unseen complex perturbations at bulk and single-cell levels.
A GDScript port of Delaunator: A fast library for Delaunay triangulation of 2D points.
The Mines Java Toolkit
slick is a simple to use polygon collision library inspired by bump.lua
Graph data structures with multiple heterogeneous metadata for Graphs.jl.
An open-source mathematical tire modelling library
Machine learning for Analysis of Proteomics in Spatial biology - Nature Communications
Repository for paper scMulan: a multitask generative pre-trained language model for single-cell analysis.
Classification and Gradient-based Localization of Chest Radiographs using PyTorch.
C# math expression library with symbolic computation support
Adaptive Graph Attention Auto-encoder for Spatial Domain Identification of Spatial Transcriptomics
Tiny header-only C++17 library for lat/lng geometry: distance, bearing, area, point-in-polygon and path proximity
An extensible .NET genetic algorithm library for optimization and artificial intelligence - Evolutionary computation and complex problem solving made simple
Graph Theory [maintainers=@chdoc,@damien-pous]
MCP server for spatial transcriptomics analysis through natural language interfaces.
The d-SEAMS C++ core engine
💬 Trace citation chains for any concept across research papers and render them as an interactive graph.
Multi-stage Riemannian flow matching for physically valid molecular docking, with GNINA scoring, PoseBusters filtering, CLI inference, and benchmarks.
📐✏️ Slides from my talk on Mathematics of Animation @ .concat() 2018
A weather server supporting Campbell Scientific and Davis Instruments stations with lots of data-sharing options
A versatile single-cell cross-modality translation method via dual-aligned variational autoencoders
A Swift Playground visualizing gravity based on Einstein's Theory of General Relativity
Fast, deterministic cell-type deconvolution for million-bin spatial transcriptomics
Java Scientific Computing Library - Signal Processing, FFT, Filters, PSD, DCT, SciPy-like APIs for JVM & Android used in Machine Learning and Data Science.
Astronomical FITS image analysis tool for detecting asteroids, comets, satellites, moving objects, and transients in astrophotography data.
A production-ready Go SDK for TRON: gRPC client with connection pooling, HD wallets, TRC-10/TRC-20, event decoding, transaction simulation, and shielded TRC-20 (Sapling) support. 85% test coverage.
Java reimplementation of Python's scikit-learn with behavioral compatibility, numerical accuracy, and idiomatic Java design