Module fep_edge_report_maker

Classes

PRMEdgeReportMaker
This class generates a PDF report for FEP+ for protein residue mutation.

Functions

create_sketcher()

parse_res_tag(label)

get_residue_label(rname, resid, cname)

get_opacity(opacity_val)

_new_sketcher_residue(sk, label, resid, resname, xyz)

Variables

IGNORE_HYDROGEN = 0

FIXUP = True
hash(x)

RESCALE = 1

STEREO = 2

OPACITY = 'opacity_value'

TORSIONS_PER_PAGE = 10

PL_INTERACTIONS = {'hb': ('#7FC97F', 'H-bonds'), 'hphb': ('#BE...

ALL_PL_INTERACTIONS = ['hb', 'hphb', 'ion', 'wb']

__package__ = 'schrodinger.application.desmond'

Variables Details

Value:

{'hb': ('#7FC97F', 'H-bonds'),
 'hphb': ('#BEAED4', 'Hydrophobic'),
 'ion': ('#F0027F', 'Ionic'),
 'wb': ('#386CB0', 'Water bridges')}