| [a1b8fee] | 1 | from __future__ import print_function |
|---|
| 2 | |
|---|
| 3 | |
|---|
| [959eb01] | 4 | if __name__ == "__main__": |
|---|
| 5 | |
|---|
| 6 | from sasModeling.iqPy import iqPy |
|---|
| 7 | #from sasModeling.analmodelpy import analmodelpy as analmodelpymodule |
|---|
| 8 | from sasModeling.geoshapespy import geoshapespy |
|---|
| 9 | from sasModeling.pointsmodelpy import pointsmodelpy |
|---|
| 10 | |
|---|
| 11 | # print "copyright information:" |
|---|
| 12 | # print " ", pointsmodelpy.copyright() |
|---|
| 13 | # print " ", pointsmodelpymodule.copyright() |
|---|
| 14 | |
|---|
| [9c3d784] | 15 | print() |
|---|
| 16 | print("module information:") |
|---|
| 17 | print(" file:", pointsmodelpy.__file__) |
|---|
| 18 | print(" doc:", pointsmodelpy.__doc__) |
|---|
| 19 | print(" contents:", dir(pointsmodelpy)) |
|---|
| 20 | print(" contents:", dir(geoshapespy)) |
|---|
| [959eb01] | 21 | |
|---|
| 22 | # a = geoshapespy.new_singlehelix(10,2,30,2) |
|---|
| 23 | #a = geoshapespy.new_sphere(20) |
|---|
| 24 | |
|---|
| 25 | iq = iqPy.new_iq(100,0.001, 0.3) |
|---|
| 26 | |
|---|
| 27 | # geoshapespy.set_orientation(a,20,40,60) |
|---|
| 28 | # geoshapespy.set_center(a,0,0,0) |
|---|
| 29 | lm = pointsmodelpy.new_loresmodel(0.1) |
|---|
| 30 | # pointsmodelpy.lores_add(lm,a,1.0) |
|---|
| 31 | |
|---|
| 32 | # b = geoshapespy.new_sphere(15) |
|---|
| 33 | # geoshapespy.set_center(b,15,15,15) |
|---|
| 34 | # pointsmodelpy.lores_add(lm,b,2.0) |
|---|
| 35 | |
|---|
| 36 | |
|---|
| 37 | c = geoshapespy.new_cylinder(10,40) |
|---|
| 38 | geoshapespy.set_center(c,1,1,1) |
|---|
| 39 | geoshapespy.set_orientation(c,0,0,0) |
|---|
| 40 | pointsmodelpy.lores_add(lm,c,3.0) |
|---|
| 41 | |
|---|
| 42 | # d = geoshapespy.new_ellipsoid(10,8,6) |
|---|
| 43 | # geoshapespy.set_center(d,3,3,3) |
|---|
| 44 | # geoshapespy.set_orientation(c,30,30,30) |
|---|
| 45 | # pointsmodelpy.lores_add(lm,d,1.0) |
|---|
| 46 | |
|---|
| 47 | vp = pointsmodelpy.new_point3dvec() |
|---|
| 48 | pointsmodelpy.get_lorespoints(lm,vp) |
|---|
| 49 | pointsmodelpy.outputPDB(lm,vp,"modelpy.pseudo.pdb") |
|---|
| 50 | |
|---|
| [9c3d784] | 51 | print("calculating distance distribution") |
|---|
| [959eb01] | 52 | rmax = pointsmodelpy.get_lores_pr(lm,vp) |
|---|
| [9c3d784] | 53 | print("finish calculating get_lores_pr, and rmax is:", rmax) |
|---|
| [959eb01] | 54 | pointsmodelpy.outputPR(lm,"testlores.pr") |
|---|
| 55 | pointsmodelpy.get_lores_iq(lm,iq) |
|---|
| 56 | |
|---|
| 57 | iqPy.OutputIQ(iq, "testlores.iq") |
|---|
| 58 | |
|---|
| [9c3d784] | 59 | print("Testing get I from a single q") |
|---|
| [959eb01] | 60 | result = pointsmodelpy.get_lores_i(lm,0.1) |
|---|
| [9c3d784] | 61 | print("The I(0.1) is: %s" % str(result)) |
|---|
| [959eb01] | 62 | |
|---|
| 63 | # version |
|---|
| 64 | __id__ = "$Id$" |
|---|
| 65 | |
|---|
| 66 | # End of file |
|---|
