Get surface area#
import molsysmt as msm
molecular_system = msm.convert(msm.systems['T4 lysozyme L99A']['181l.h5msm'],
selection='molecule_type=="protein"')
sa_groups = msm.physchem.get_surface_area(molecular_system, element='group', definition='collantes')
view = msm.view(molecular_system)
msm.thirds.nglview.set_color_by_value(view, values=sa_groups, min_value=0.0, cmap="Purples")
view