Študent bo dobil vpogled v probleme biomolekularnih simulacij: kvantno mehanske metode, metode na osnovi molekulske mehanike, ki omogočajo termično povprečenje, modeliranje kemijskih reakcij v raztopinah, encimatske reakcije in načrtovanje inhibitorjev. Sestavni del predmeta je praktično delo z računalnikom.
Splošne kompetence:
- obvladanje raziskovalnih metod, postopkov inprocesov, razvoj kritične in samokritične presoje,
- sposobnost uporabe znanja v praksi,
- razvoj komunikacijskih sposobnosti in spretnosti, posebej komunikacije v mednarodnem okolju,
- kooperativnost, delo v skupini (in v mednarodnem okolju)
Predmetnospecifične kompetence:
- Predmet pripravlja študente za uporabo znanja s področja biomolekularnih simulacij.
Students will gain insight into the problems of intermolecular simulations: quantum-mechanical methods, molecular mechanics-based methods enabling thermal averaging, the modelling of chemical reactions in solutions, enzymatic reactions and the planning of inhibitors. Practical work involving the use of computers constitutes an integral part of this course.
General Competences:
- The student will master research methods, procedures and processes
- The student will develop critical thinking
- The student will develop communications skills to present research achievement in the international environment
- Work in team (in international environment)
Course Specific Competences:
- This course prepares students to apply knowledge of biomolecular simulations.