Contact: karel.berka@upol.cz

Keywords: in silico drug design, Drug design, Drug discovery, Drug screening, Pharmacophores, Chemical biology, QSAR, Molecular docking, molecular modelling, De novo modeling, Deep Learning, Cheminformatics, AlphaFold, AlphaFold Database, AI structure prediction, AI based tools, AlphaFold Database (13181), Quantum mechanics/molecular mechanics

Venue: Faculty of Science, Palacky University Olomouc, 17. listopadu 1192/12

City: Olomouc

Region: Olomoucký kraj

Country: Czech Republic

Postcode: 77900

Learning objectives:

usage of in silico drug design methods such as molecular docking, cofolding, QSAR, pharmacophores, molecular dynamics, de novo modelling

Organizer: Karel Berka, Pavel Polishchuk

Host institutions: Palacky University Olomouc

Eligibility:

• First come first served
• Registration of interest

Target audience: Master students, PhD Students, Post Docs, Life Science Researchers

Capacity: 80

Event types:

• Workshops and courses

Credit / Recognition: Certificate

Cost basis: Free to all

Sponsors: ELIXIR CZ, Palacky University Olomouc, Aurora Alliance, ERASMUS+

Scientific topics: Drug discovery, Drug development, Structure analysis, Data acquisition, Molecular modelling, Computational biology, Computational chemistry, Cheminformatics, Structure prediction, Pharmacology

Operations: Molecular docking, Molecular surface analysis, Structure database search, Structure analysis, Chemical similarity enrichment, Binding site prediction, Residue contact prediction, Residue interaction calculation, Trajectory visualization, Optimisation and refinement, Protein property calculation, Protein structure prediction, Simulation analysis, Feature selection, Feature extraction, Hydrogen bond calculation, Ligand-binding site prediction, Molecular dynamics