Package schrodinger :: Package application :: Package glide :: Module xpdes :: Class XpDesReader

Class XpDesReader

Class for parsing XP descriptor (.xpdes) files Written by Rajorshi Biswas Original version was not parsing the first line correctly (it was assuing the title is an integer). Modified to ignore title and reference data blocks by ligand number and pose number

Instance Methods

[hide private]

__init__(self, filename)

_addBlock(self, blockdata, lignum, posenum)
Save specified block as <lignum>, <posenum>

getBlock(self, lignum, posenum)
Given ligand number and posenumber, return XP data block