developing projects on
SBM
Structure-Based Models
in all All-Atom and Carbon-alpha graining
MODELING
Protein modeling prior to SBM MD thermodynamics and kinectis characterization
DIFFUSION
Protein folding diffusion
with SBM molecular dynamics simulations
DOCKING
Synthesis-docking evaluation of drugs candidates to disease treatment
THERMODYNAMICS
Thermodynamics characterization of protein using SBM MD simulations
KINETICS
Kinetics characterization using SBM simulations and analytical diffusion equations