In silico Laboratory for Innovation in Drug Discovery
  • Software
    • BoBER Web Server - Base of Bioisosteric Replacements
    • CaNDis Web Server - Diseases Network
    • GenProBiS Web Server - Predict Sequence Variants in Protein Binding Sites
    • ProBiS Server - Predict Protein Binding Sites and Ligands
    • ProBiS-CHARMMing Server - Optimize Predicted Ligands
    • ProBiS Algorithm - Local Pairwise Alignment of Protein Structures
    • ProBiS Plugin - GUI for PyMOL and Chimera
    • ProBiS H2O - Identify conserved water sites
    • ProBiS H2O MD - Identify conserved waters from MD
    • ProBiS-Dock Algorithm - Hybrid Multitemplate Homology Flexible Docking Algorithm
    • ProBiS-Dock Database - Repository of Druggable Binding Sites
    • ProBiS-Fold Web Server - Binding Sites for Human Proteome
    • LiSiCA - Ligand-based Virtual Screening Software
    • LiSiCA Plugin - GUI for PyMOL
    • MCQD - Improved Maximum Clique Algorithm
    • MCQD-ML - Machine Learning Assisted Maximum Clique Algorithm
    • MCQDW - Maximum Weight Clique Algorithm
    • KCQDW - Highest Weight k-clique Algorithm
    • MaxCliquePara - Parallel Maximum Clique Algorithm
    • ENZO Server - Construct and Test Kinetic Models of Enzyme Reactions
  • Datasets
  • Publications
  • Key Personnel
  • Statistics
Featured tools ProBiS Algorithm ProBiS H2O ProBiS H2O MD ProBiS-Dock Maximum Clique LiSiCA Maximum Weight Clique
In silico Laboratory

Structural bioinformatics and tools for drug discovery.

Get in touch

Questions about our software, datasets, or research?

konc@cmm.ki.si
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