ProBiS-Fold Approach for Annotation of Human Structures from the AlphaFold Database with No Corresponding Structure in the PDB to Discover New Druggable Binding Sites von Konc, Janez, Janežič, Dušanka

Volltext

ProBiS algorithm for detection of structurally similar protein binding sites by local structural alignment von Konc, Janez, Janežič, Dušanka

Volltext

Ensemble Docking Coupled to Linear Interaction Energy Calculations for Identification of Coronavirus Main Protease (3CL(pro)) Non-Covalent Small-Molecule Inhibitors von Jukic, Marko, Janezic, Dusanka, Bren, Urban

Volltext

Identification of Conserved Water Sites in Protein Structures for Drug Design von Jukič, Marko, Konc, Janez, Gobec, Stanislav, Janežič, Dušanka

Volltext

ProBiS-ligands: a web server for prediction of ligands by examination of protein binding sites von Konc, Janez, Janežič, Dušanka

Volltext

Discovery of Novel Potential Human Targets of Resveratrol by Inverse Molecular Docking von Kores, Katarina, Lešnik, Samo, Bren, Urban, Janežič, Dušanka, Konc, Janez

Volltext

Potential Novel Thioether-Amide or Guanidine-Linker Class of SARS-CoV-2 Virus RNA-Dependent RNA Polymerase Inhibitors Identified by High-Throughput Virtual Screening Coupled to Fre... von Jukic, Marko, Janezic, Dusanka, Bren, Urban

Volltext

ProBiS-Dock Database: A Web Server and Interactive Web Repository of Small Ligand–Protein Binding Sites for Drug Design von Konc, Janez, Lešnik, Samo, Škrlj, Blaž, Janežič, Dušanka

Volltext

Protein binding sites for drug design von Konc, Janez, Janežič, Dušanka

Volltext

An exact algorithm to find a maximum weight clique in a weighted undirected graph von Rozman, Kati, Ghysels, An, Janežič, Dušanka, Konc, Janez

Volltext

Binding site comparison for function prediction and pharmaceutical discovery von Konc, Janez, Janežič, Dušanka

Volltext

LiSiCA: A Software for Ligand-Based Virtual Screening and Its Application for the Discovery of Butyrylcholinesterase Inhibitors von Lešnik, Samo, Štular, Tanja, Brus, Boris, Knez, Damijan, Gobec, Stanislav, Janežič, Dušanka, Konc, Janez

Volltext

ProBiS tools (algorithm, database, and web servers) for predicting and modeling of biologically interesting proteins von Konc, Janez, Janežič, Dušanka

Volltext

ProBiS H2O MD Approach for Identification of Conserved Water Sites in Protein Structures for Drug Design von Jukič, Marko, Konc, Janez, Janežič, Dušanka, Bren, Urban

Volltext

Individual degrees of freedom and the solvation properties of water von Bren, Urban, Janežič, Dušanka

Volltext

ProBiS-CHARMMing: Web Interface for Prediction and Optimization of Ligands in Protein Binding Sites von Konc, Janez, Miller, Benjamin T, Štular, Tanja, Lešnik, Samo, Woodcock, H. Lee, Brooks, Bernard R, Janežič, Dušanka

Volltext

ProBiS-2012: web server and web services for detection of structurally similar binding sites in proteins von Konc, Janez, Janezic, Dusanka

Volltext

ProBiS: a web server for detection of structurally similar protein binding sites von Konc, Janez, Janežič, Dušanka

Volltext

Exact Parallel Maximum Clique Algorithm for General and Protein Graphs von Depolli, Matjaž, Konc, Janez, Rozman, Kati, Trobec, Roman, Janežič, Dušanka

Volltext

Repurposing of Drugs for SARS-CoV-2 Using Inverse Docking Fingerprints von Jukic, Marko, Kores, Katarina, Janezic, Dusanka, Bren, Urban

Volltext