Frequency Modulation of the Raman Spectrum at The Interface DNA - ZrO2 Nanoparticles

Molecular dynamics simulations of Lithium Fluoride aqueous solutions: Effects of ion concentration on the structural and dynamical properties at T=300 K

Modeling of DNA Radiation damage and Biological Response using Monte Carlo Simulation technique

The Quantum-Chemistry Calculations of Electronic Structure of Boron Nitride Nanocrystals with Density Functional Theory Realization

Synthesis, Speciation, DNA Binding, Electrochemical and Antiproliferative Properties of Pd(II) Complexes Designed to Improve the Interaction with DNA

ICMMS2: Molecular Modeling Study for Graphene modified with CH3, COOH, NH2 and O2

Adsorption Modes of Natural Organic Matters on Fabricated Calcite Ooids Surfaces Using Molecular Dynamic Simulations Study

ICMMS-2: Molecular Modeling Analyses of Polyvinyl Alcohol/ Sodium Alginate/ZnO Composite

Molecular dynamics simulations of s-triazine-based MMP-10 inhibitor with ferroptosis induction capacity and potent anti-colorectal cancer activities

Density Functional Theory (DFT) Investigation and Molecular Docking Simulation of 1, 2, 4-triazole Derivatives as Potent Inhibitors Against a Receptor (DNA Gyrase)