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Module: acceptorGeom FindHBond/acceptorGeom.py

acceptor geometry testing functions

Imported modules   
import base
from chimera import Xform_lookAt, sqdistance, angle, Vector, cross
from chimera.bondGeom import bondPositions
from chimera.idatm import typeInfo, geometry, substituents, tetrahedral
from commonGeom import testPhi, getPhiPlaneParams, testTheta, sulphurCompensate
from hydpos import hydPositions
Functions   
accGeneric
accPhiPsi
accSynAnti
accThetaTau
testPhiPsi
testThetaTau
  accGeneric 
accGeneric (
        donor,
        donorHyds,
        acceptor,
        r2,
        minAngle,
        )

  accPhiPsi 
accPhiPsi (
        donor,
        donorHyds,
        acceptor,
        bonded1,
        bonded2,
        r2,
        phi,
        theta,
        )

  accSynAnti 
accSynAnti (
        donor,
        donorHyds,
        acceptor,
        synAtom,
        planeAtom,
        synR2,
        synPhi,
        synTheta,
        antiR2,
        antiPhi,
        antiTheta,
        )

planeAtom (in conjunction with acceptor, and with synAtom defining the up direction) defines a plane. If donor is on the same side as synAtom, use syn params, otherwise anti params.

  accThetaTau 
accThetaTau (
        donor,
        donorHyds,
        acceptor,
        upsilonPartner,
        r2,
        upsilonLow,
        upsilonHigh,
        theta,
        )

  testPhiPsi 
testPhiPsi (
        dp,
        donorHyds,
        ap,
        bp,
        phiPlane,
        r2,
        phi,
        theta,
        )

  testThetaTau 
testThetaTau (
        dp,
        donorHyds,
        ap,
        pp,
        upsilonLow,
        upsilonHigh,
        theta,
        )


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