potUtils
index
/home/schwitrs/bzr-repo/xplor-python3/bin.Linux_x86_64/potUtils.py


Helper utilities for Xplor-NIH energy terms
 
Functions
 
  stripBracketedComments(string) - return a string with XPLOR-style
                                   comments delimited by curly braces
                                   ({}) removed. This function does
                                   not remove single-line comments
                                   introduced by the (!) character.
 
 eulerFromRotMat(rotMat) - returns alpha, beta, gamma Euler angles (in degrees)
                           from a rotation matrix in 3-dimensional space
                           specified as a mat3.Mat3.
 
 rotMatFromEuler(alpha,  - given alpha, beta, gamma Euler angles, return 
                 beta,     a mat3.Mat3 specifying the corresponding
                 gamma)    rotation matrix in 3-dimensional space.
 
 
 
# This file was automatically generated by SWIG (http://www.swig.org).
# Version 4.0.2
#
# Do not make changes to this file unless you know what you are doing--modify
# the SWIG interface file instead.

 
Classes
       
builtins.object
BogusAtomSel

 
class BogusAtomSel(builtins.object)
    BogusAtomSel(*args, **kwargs)
 

 
  Methods defined here:
__init__(self, *args, **kwargs)
Initialize self.  See help(type(self)) for accurate signature.
__repr__ = _swig_repr(self)

Static methods defined here:
__swig_destroy__ = delete_BogusAtomSel(...)

Data descriptors defined here:
__dict__

 
dictionary for instance variables (if defined)
__weakref__

 
list of weak references to the object (if defined)
thisown

 
The membership flag

 
Functions
       
eulerFromRotMat(*args, **kwargs) -> 'Vec3'
pyXplorHelp(*args) -> 'String'
rotMatFromEuler(*args, **kwargs) -> 'Mat3'
stripBracketedComments(*args, **kwargs) -> 'String'

 
Data
        cvar = <Swig global variables>