Alternatives and similar repositories for AIDD-Tutorial

Users that are interested in AIDD-Tutorial are comparing it to the libraries listed below

• beikwx / SailVina
  SailVina重构增强版
  ☆96Updated last year
• Computer-Aided-Drug-Design / AIDD-Tutorial-Files
  AIDD Tutorial Files，人工智能药物设计教程相关文件
  ☆17Updated 3 years ago
• MengwuXiao / GetBox-PyMOL-Plugin
  A PyMOL Plugin for calculating docking box for LeDock, AutoDock and AutoDock Vina.
  ☆113Updated 6 years ago
• Computer-Aided-Drug-Design / CADD-tutorial
  CADD（计算机辅助药物设计）学习资料
  ☆75Updated 2 years ago
• guyujun / pyrosetta-basic
  ☆177Updated 4 years ago
• haddocking / haddock3
  Official repo of the modular BioExcel version of HADDOCK
  ☆214Updated last week
• daiyun02211 / awesome-AIDD
  Awesome AI-aided Drug Discovery
  ☆30Updated last year
• haddocking / prodigy
  Predict the binding affinity of protein-protein complexes from structural data
  ☆165Updated 2 months ago
• ProteinDesignLab / protein-design-tutorials
  Tutorials, cheat sheets, and other resources for computational methods for protein design.
  ☆124Updated 2 years ago
• CharlesHahn / DuIvyTools
  A Tool to process and visualize the results of molecular dynamics simulations(GROMACS).
  ☆90Updated 2 months ago
• itWangCode / AI-Drug-Discovery-Design
  AI drug design
  ☆34Updated last year
• Wang-Lin-boop / CADD-Scripts
  Scripts for virtual screening, cross docking and protein relax using Schrödinegr and Rosetta
  ☆84Updated 8 months ago
• CAODH / SurfDock
  SurfDock is a Surface-Informed Diffusion Generative Model for Reliable and Accurate Protein-ligand Complex Prediction
  ☆224Updated 2 months ago
• KailiWang1 / DeepDTAF
  a deep learning architecture for protein-ligand binding affinity prediction
  ☆76Updated last year
• DweipayanG / GROMACS-Protein-Ligand
  ☆58Updated 3 years ago
• cgohlke / pymol-open-source-wheels
  Pymol-open-source wheels for Python on Windows.
  ☆167Updated last month
• ChatMol / gromacs_copilot
  Let LLM run your MDs.
  ☆238Updated 3 months ago
• twopin / CAMP
  predicting peptide-protein interactions
  ☆136Updated 2 years ago
• SysBioChalmers / DLKcat
  Deep learning and Bayesian approach applied to enzyme turnover number for the improvement of enzyme-constrained genome-scale metabolic mo…
  ☆175Updated 2 years ago
• Luo-SynBioLab / UniKP
  ☆89Updated last year
• ZeroDesigner / AwsomeCADD
  好的CADD教程，资源总结
  ☆25Updated last year
• DeltaGroupNJUPT / Vina-GPU-2.1
  Vina-GPU 2.1, an improved docking toolkit for faster speed and higher accuracy on the virtual screening
  ☆135Updated last year
• ToHanwei / Rosetta-Chinese
  Rosetta翻译
  ☆27Updated 3 years ago
• QVina / qvina
  Accurately speed up AutoDock Vina
  ☆155Updated 2 years ago
• Kortemme-Lab / flex_ddG_tutorial
  ☆135Updated 3 years ago
• lifanchen-simm / transformerCPI2.0
  Sequence-to-drug concept adds a perspective on drug design. It can serve as an alternative method to SBDD, particularly for proteins that…
  ☆77Updated 2 years ago
• dptech-corp / Uni-Dock
  Uni-Dock: a GPU-accelerated molecular docking program
  ☆267Updated last week
• Valdes-Tresanco-MS / gmx_MMPBSA
  gmx_MMPBSA is a new tool based on AMBER's MMPBSA.py aiming to perform end-state free energy calculations with GROMACS files.
  ☆287Updated 2 weeks ago
• rifdock / rifdock
  Rifdock Library for Conformational Search
  ☆165Updated last year
• cbalbin-bio / pymol-color-alphafold
  PyMOL extension to color AlphaFold structures by confidence (pLDDT).
  ☆117Updated last year