66 citations · 303 across the 26 of their papers we have counts for
3 papers · 1 filter
Irradiation driven molecular dynamics simulation of the FEBID process for Pt(PF)
Alexey Prosvetov, Alexey V. Verkhovtsev, Gennady B. Sushko +1
This paper presents a detailed computational protocol for atomistic simulation of the formation and growth of metal-containing nanostructures during the Focused Electron Beam Induc…
Reactive molecular dynamics simulations of organometallic compound W(CO)6 fragmentation
Pablo de Vera, Alexey Verkhovtsev, Gennady Sushko +1
Irradiation- and collision-induced fragmentation studies provide information about geometry, electronic properties and interactions between structural units of various molecular sy…
Studying chemical reactions in biological systems with MBN Explorer: implementation of molecular mechanics with dynamical topology
Gennady B. Sushko, Ilia A. Solov'yov, Alexey V. Verkhovtsev +2
The concept of molecular mechanics force field has been widely accepted nowadays for studying various processes in biomolecular systems. In this paper, we suggest a modification fo…