Alternatives and similar repositories for PKPD

Users that are interested in PKPD are comparing it to the libraries listed below

• DGadaleta88 / data_curation_workflow
  ☆13Updated last year
• Popov-Lab-UNC / DELi
  A package for calling DEL selections and running data analysis on the results
  ☆13Updated last week
• pgniewko / solubility
  My (small) research project in solubility of drug-like molecules
  ☆18Updated 5 years ago
• Saminakausar / Automated-framework-for-QSAR-model-building
  ☆10Updated 6 years ago
• sekijima-lab / mermaid
  ☆11Updated 4 years ago
• AlanHassen / led3score
  ☆13Updated last year
• jidushanbojue / YaSAScore
  Prediction of compound synthesis accessibility bashed on reaction knowledge graph
  ☆18Updated 3 years ago
• gaoqiweng / PROTAC-Model
  Integrative modeling of PROTAC-mediated ternary complex
  ☆28Updated 3 years ago
• aws-samples / eggnet-equivariant-graph-of-graph-neural-network
  ☆10Updated 2 years ago
• MolecularAI / DockStreamCommunity
  ☆28Updated 2 years ago
• whymin / HOB
  Machine learning model for predicting Human Oral Bioavailability
  ☆13Updated 4 years ago
• PKPDAI / PKDocClassifier
  Binary classifier to identify scientific publications reporting pharmacokinetic parameters estimated in vivo
  ☆21Updated 2 years ago
• taoshen99 / AutoMolDesigner
  The official open-source repository for AutoMolDesigner, an easy-to-use Python application dedicated to automated molecular design.
  ☆31Updated last year
• czodrowskilab / Multiprotic-pKa-Processing
  ☆14Updated 3 years ago
• Novartis / pQSAR
  Massively multitask stacked model for predicting activity of thousands of biological assays
  ☆34Updated 4 years ago
• martin-sicho / genui-gui
  GenUI frontend application. It provides a GUI to the GenUI REST API web services.
  ☆22Updated 2 years ago
• QVina / QVina.github.io
  The code for the QuickVina homepage.
  ☆36Updated 3 years ago
• uibcdf / PyPharmer
  Python API for Pharmer
  ☆12Updated 6 years ago
• jamesgleave / Deep-Docking-NonAutomated
  ☆52Updated 3 years ago
• sdecesco / CNS_MPO
  Python code that takes a SDF file as input to calculate the central nervous system multiparameter optimization (CNS MPO) score
  ☆11Updated 7 years ago
• radifar / pyplif
  Automatically exported from code.google.com/p/pyplif
  ☆10Updated 7 years ago
• lithium0003 / JSME_ipywidget
  JSME Molecule Editor ipywidget for jupyter notebook
  ☆12Updated 6 months ago
• Actelion / openchemlib-hyperspace
  substructure search in large combinatorial spaces using openchemlib
  ☆22Updated 2 weeks ago
• martin-sicho / genui
  The backend services of the GenUI framework. The backend provides the REST API used for molecular generation, QSAR modelling and chemical…
  ☆35Updated 10 months ago
• chembl / compound_target_pairs_dataset
  Automatic extraction of interacting compound-target pairs from ChEMBL.
  ☆21Updated 4 months ago
• cadd-synthetic / GASA
  Synthetic Accessible Prediction of Organic Compounds based on Graph Attention Mechanism
  ☆22Updated 2 years ago
• sirimullalab / openDMPK
  Open Drug Metabolism & PharmacoKinetics (OpenDMPK) is an open source data resource and toolkit for predicting drug metabolism and pharmac…
  ☆26Updated 4 years ago
• ci-lab-cz / ibenchmark
  Benchmark interpretation of QSAR models
  ☆15Updated 3 years ago
• Sanofi-Public / IDD-papers-generative-applicability-domains
  Repository for the code associated with the paper Impact of applicability domains by Maxime Langevin et al.
  ☆13Updated 11 months ago
• biotite-dev / molmarbles
  A bridge between Biotite and OpenMM
  ☆15Updated 10 months ago