active-sites

There are 0 repository under active-sites topic.

• PaccMann / paccmann_kinase_binding_residues

  Comparison of active site and full kinase sequences for drug-target affinity prediction and molecular generation. Full paper: https://pubs.acs.org/doi/10.1021/acs.jcim.1c00889

  kinasesprotein-ligand-interactionsactive-sitesmachine-learningproteochemometricsknn
  Language:Python 35

• illusionic / BSite-pro

  Code for paper titled, "BSite-pro: A Novel Approach for Binding Site Prediction in Protein Sequences".

  protein-sequencesextract-featuresmachine-learningrandom-forestclassificationbinding-sitesactive-sitesconserved-sitespublication-datapublication-codebioinformatics
  Language:Python 2

• sambitmishra0628 / AR-PRED_source

  Predicting allosteric and active site residues in proteins with machine learning and protein sequence, structure and dynamics features

  active-sitesallosteric-siteelastic-network-modelsmachine-learningprotein-dynamicsrandom-forest-classifier
  Language:MATLAB 2

• anonymous913 / Project

  My Portfolio Site

  active-sites
  Language:HTML 1

• ugSUBMARINE / motif-search

  Searching for motifs / side chain constellations in a proteins structure

  active-sitesprotein-structurepython3structure-motif
  Language:Python 1

• Sarah-Hesham-2022 / Drug-Design-AutoDock-Tools-MBP-D-Ribose

  Molecular docking is one of the molecular modeling methods that predicts the preferred orientation of one molecule (ligand) to another (receptor) when bound to each other to form a stable complex (lowest energy state).

  active-sitesautodockbioinformaticsbiologyblind-dockingligandmolecular-dockingproteinreceptorstructural-analysisstructural-biologyreceptor-ligand-interactionescherichia-colimbpd-ribosecomputer-graphics-algorithms