Senior researcher, lecturer
Institute of Chemical Physics
Faculty of Physics, Vilnius University
Tel.: (+370) 5 223 4593
Location: room B320 at the NFTMC building, Saulėtekio al. 3, Vilnius
Students are kindly invited to join for a science practice during summer 2018 financed by Research Council of Lithuania. If interested please contact me using contact information above and refer to this page for more information (in Lithuanian only) .
Quantum chemical predictions of acidity constants of drug-like compounds
Classical molecular dynamics simulations of liquid phases including ordinary solutions, ionic liquids and biological systems
Combined quantum mechanics/molecular mechanics modeling of spectroscopic UV/vis and NMR properties of molecules in solution
Quantum mechanics/molecular dynamics modelling of structure, dynamics and NMR properties of imidazolium based ionic liquids
Prof. Francesca Mocci, University of Cagliari, Sardinia, Italy
Computational 17O NMR of peptides in solution
Computational quadrupolar NMR of biosystems and ionic liquids
Prof. Andrés Cedillo, Autonomous Metropolitan University, Mexico City, Mexico
Quantum chemical predictions of acidities in aqueous solution
Highly motivated students are invited to work on their bachelor or master thesis in the field of molecular modeling! If interested please come and talk to me.