Romanov Aleksey Nikolaevich

Publications in Math-Net.Ru

1. The coherent control of relaxation processes in excited states of 4-dimethylaminochalkone fluorescent probe. Results of quantum chemical simulation
   
   Num. Meth. Prog., 14:4 (2013),  432–437
2. The MEL program for the atomistic modeling of functional layers in solar cells
   
   Num. Meth. Prog., 13:3 (2012),  413–423
3. Calculation of excited states of the polycation Bi$_5^3+$ by the spin-orbit configuration interaction method
   
   Num. Meth. Prog., 12:4 (2011),  443–449
4. Quantum-chemical modeling of excited states of Bismuth monocations
   
   Num. Meth. Prog., 12:4 (2011),  417–422
5. The SOL docking package for computer-aided drug design
   
   Num. Meth. Prog., 9:3 (2008),  213–233
6. Computation of contribution from the cavity effect to protein-ligand binding free energy
   
   Num. Meth. Prog., 9:1 (2008),  101–107
7. A two-step method for the evaluation of free energy of formation for subnanometer cavities.
   
   Num. Meth. Prog., 8:4 (2007),  326–333
8. An algorithm of assigning the force parameters to atoms of organic molecules and proteins in the framework of the MMFF94 force field
   
   Num. Meth. Prog., 7:4 (2006),  128–136