sirpan's Stars
zervel3/IS-algorithm
The algorithm to quantify individuals influence and susceptibility from individual interaction data
eugenebang/DREAMwalk
The official code implementation for DREAMwalk in Python.
kaist-sbml/MGP_prediction
Zhu-BY/ALGE
Repository of the paper "Precise influence evaluation in complex networks" by B. Zhu, D. Li and Q. Sun
hhdo/TiPNN
This is the official code release of the following paper: Hao Dong et al., Temporal Inductive Path Neural Network for Temporal Knowledge Graph Reasoning.
Yiminghh/VertexEntanglement
parthoBTK/Personalized_Liver_Models
Scripts and wrappers for GSMM
opencobra/cobrapy
COBRApy is a package for constraint-based modeling of metabolic networks.
sysbiolux/Helgueta_et_al_2023
Companion repo for the article by Sergio Helgueta et al.
rdkit/mmpdb
A package to identify matched molecular pairs and use them to predict property changes.
zyzisastudyreallyhardguy/Graph-Group-Discrimination
Code for NeurIPS 2022 paper "Rethinking and Scaling Up Graph Contrastive Learning: An Extremely Efficient Approach with Group Discrimination"
tianyu139/data-efficient-augmentation
Code for Data-Efficient Augmentation for Training Neural Networks (NeurIPS 2022)
autumn9999/MTC-with-Category-Shifts
KChen-lab/METAFlux
SysBioChalmers/RAVEN
The RAVEN Toolbox for genome scale model reconstruction, curation and analysis.
qLSLab/GPRuler
GPRuler, an open-source computational framework to automate the reconstruction process of Gene-Protein-Reaction (GPR) rules within metabolic networks of a given organism based on the corresponding list of genes involved in catalysis of each metabolic reaction, and genes-to-reaction associations.
SysBioChalmers/Human-GEM
The generic genome-scale metabolic model of Homo sapiens
csbl/ratcon1
Reconciled rat and human metabolic networks for comparative toxicogenomics analyses and biomarker predictions
ATOMScience-org/AMPL
The ATOM Modeling PipeLine (AMPL) is an open-source, modular, extensible software pipeline for building and sharing models to advance in silico drug discovery.
d2l-ai/d2l-zh
《动手学深度学习》:面向中文读者、能运行、可讨论。中英文版被70多个国家的500多所大学用于教学。
GaiZhenbiao/ChuanhuChatGPT
GUI for ChatGPT API and many LLMs. Supports agents, file-based QA, GPT finetuning and query with web search. All with a neat UI.
ShaoQiBNU/stacking
集成学习Stacking方法详解
ikki407/stacking
Stacked Generalization (Ensemble Learning)
mldlproject/2021-iCYP-MFE
Source code and data of the paper entitled "iCYP-MFE: Identifying Human Cytochrome P450 Inhibitors using Multi-task Learning and Molecular Fingerprint-embedded Encoding"
biomed-AI/PROTAC-RL
Merck/DeepNeuralNet-QSAR
emreg00/toolbox
Toolbox - generic utilities for data processing (e.g., parsing, proximity, guild scoring, etc...)
CompBtBs/Prediction_Flavoprotein_EM
This repository contains the data and script used for the manuscript "Machine learning for efficient prediction of protein redox potential: the flavoproteins case" submitted to the Journal of Chemical Information and Modeling.
FFrankyy/FINDER
FINDER - FInding key players in complex Networks through DEep Reinforcement learning (Nature Machine Intelligence)
mldlproject/2021-NPBERT-Antimalaria
Source code and data of the paper entitled "Predicting Antimalarial Activity in Natural Products Using Pretrained Bidirectional Encoder Representations from Transformers"