numpy-quaternion 2023.0.4

Add a quaternion dtype to NumPy

Quaternions in numpy

This Python module adds a quaternion dtype to NumPy.

The code was originally based on code by Martin Ling (which he wrote with help from Mark Wiebe), but was rewritten with ideas from rational to work with newer python versions (and to fix a few bugs), and greatly expands the applications of quaternions.

See also the pure-python package quaternionic.

Quickstart

conda install -c conda-forge quaternion

or

python -m pip install --upgrade --force-reinstall numpy-quaternion

Optionally add --user after install in the second command if you're not using a python environment — though you should start.

Dependencies

The basic requirements for this code are reasonably current versions of python and numpy. In particular, python versions 3.8 through 3.11 are routinely tested. Earlier python versions, including 2.7, will work with older versions of this package; they might still work with more recent versions of this package, but even numpy no longer supports python previous to 3.8, so your mileage may vary. Also, any numpy version greater than 1.13.0 should work, but the tests are run on the most recent release at the time of the test.

However, certain advanced functions in this package (including squad, mean_rotor_in_intrinsic_metric, integrate_angular_velocity, and related functions) require scipy and can automatically use numba. Scipy is a standard python package for scientific computation, and implements interfaces to C and Fortran codes for optimization (among other things) need for finding mean and optimal rotors. Numba uses LLVM to compile python code to machine code, accelerating many numerical functions by factors of anywhere from 2 to 2000. It is possible to run all the code without numba, but these particular functions can be anywhere from 4 to 400 times slower without it.

Both scipy and numba can be installed with pip or conda. However, because conda is specifically geared toward scientific python, it is generally more robust for these more complicated packages. In fact, the main anaconda package comes with both numba and scipy. If you prefer the smaller download size of miniconda (which comes with minimal extras), you'll also have to run this command:

conda install numpy scipy numba

Installation

Assuming you use conda to manage your python installation (which is currently the preferred choice for science and engineering with python), you can install this package simply as

conda install -c conda-forge quaternion

If you prefer to use pip, you can instead do

python -m pip install --upgrade --force-reinstall numpy-quaternion

(See here for a veteran python core contributor's explanation of why you should always use python -m pip instead of just pip or pip3.) The --upgrade --force-reinstall options are not always necessary, but will ensure that pip will update numpy if it has to.

If you refuse to use conda, you might want to install inside your home directory without root privileges. (Conda does this by default anyway.) This is done by adding --user to the above command:

python -m pip install --user --upgrade --force-reinstall numpy-quaternion

Note that pip will attempt to compile the code — which requires a working C compiler.

Finally, there's also the fully manual option of just downloading the code, changing to the code directory, and running

python -m pip install --upgrade --force-reinstall .

This should work regardless of the installation method, as long as you have a compiler hanging around.

Basic usage

The full documentation can be found on Read the Docs, and most functions have docstrings that should explain the relevant points. The following are mostly for the purposes of example.

>>> import numpy as np
>>> import quaternion
>>> np.quaternion(1,0,0,0)
quaternion(1, 0, 0, 0)
>>> q1 = np.quaternion(1,2,3,4)
>>> q2 = np.quaternion(5,6,7,8)
>>> q1 * q2
quaternion(-60, 12, 30, 24)
>>> a = np.array([q1, q2])
>>> a
array([quaternion(1, 2, 3, 4), quaternion(5, 6, 7, 8)], dtype=quaternion)
>>> np.exp(a)
array([quaternion(1.69392, -0.78956, -1.18434, -1.57912),
       quaternion(138.909, -25.6861, -29.9671, -34.2481)], dtype=quaternion)

Note that this package represents a quaternion as a scalar, followed by the x component of the vector part, followed by y, followed by z. These components can be accessed directly:

>>> q1.w, q1.x, q1.y, q1.z
(1.0, 2.0, 3.0, 4.0)

However, this only works on an individual quaternion; for arrays it is better to use "vectorized" operations like as_float_array.

The following ufuncs are implemented (which means they run fast on numpy arrays):

add, subtract, multiply, divide, log, exp, power, negative, conjugate,
copysign, equal, not_equal, less, less_equal, isnan, isinf, isfinite, absolute

Quaternion components are stored as double-precision floating point numbers — floats, in python language, or float64 in more precise numpy language. Numpy arrays with dtype=quaternion can be accessed as arrays of doubles without any (slow, memory-consuming) copying of data; rather, a view of the exact same memory space can be created within a microsecond, regardless of the shape or size of the quaternion array.

Comparison operations follow the same lexicographic ordering as tuples.

The unary tests isnan and isinf return true if they would return true for any individual component; isfinite returns true if it would return true for all components.

Real types may be cast to quaternions, giving quaternions with zero for all three imaginary components. Complex types may also be cast to quaternions, with their single imaginary component becoming the first imaginary component of the quaternion. Quaternions may not be cast to real or complex types.

Several array-conversion functions are also included. For example, to convert an Nx4 array of floats to an N-dimensional array of quaternions, use as_quat_array:

>>> import numpy as np
>>> import quaternion
>>> a = np.random.rand(7, 4)
>>> a
array([[ 0.93138726,  0.46972279,  0.18706385,  0.86605021],
       [ 0.70633523,  0.69982741,  0.93303559,  0.61440879],
       [ 0.79334456,  0.65912598,  0.0711557 ,  0.46622885],
       [ 0.88185987,  0.9391296 ,  0.73670503,  0.27115149],
       [ 0.49176628,  0.56688076,  0.13216632,  0.33309146],
       [ 0.11951624,  0.86804078,  0.77968826,  0.37229404],
       [ 0.33187593,  0.53391165,  0.8577846 ,  0.18336855]])
>>> qs = quaternion.as_quat_array(a)
>>> qs
array([ quaternion(0.931387262880247, 0.469722787598354, 0.187063852060487, 0.866050210100621),
       quaternion(0.706335233363319, 0.69982740767353, 0.933035590130247, 0.614408786768725),
       quaternion(0.793344561317281, 0.659125976566815, 0.0711557025000925, 0.466228847713644),
       quaternion(0.881859869074069, 0.939129602918467, 0.736705031709562, 0.271151494174001),
       quaternion(0.491766284854505, 0.566880763189927, 0.132166320200012, 0.333091463422536),
       quaternion(0.119516238634238, 0.86804077992676, 0.779688263524229, 0.372294043850009),
       quaternion(0.331875925159073, 0.533911652483908, 0.857784598617977, 0.183368547490701)], dtype=quaternion)

[Note that quaternions are printed with full precision, unlike floats, which is why you see extra digits above. But the actual data is identical in the two cases.] To convert an N-dimensional array of quaternions to an Nx4 array of floats, use as_float_array:

>>> b = quaternion.as_float_array(qs)
>>> b
array([[ 0.93138726,  0.46972279,  0.18706385,  0.86605021],
       [ 0.70633523,  0.69982741,  0.93303559,  0.61440879],
       [ 0.79334456,  0.65912598,  0.0711557 ,  0.46622885],
       [ 0.88185987,  0.9391296 ,  0.73670503,  0.27115149],
       [ 0.49176628,  0.56688076,  0.13216632,  0.33309146],
       [ 0.11951624,  0.86804078,  0.77968826,  0.37229404],
       [ 0.33187593,  0.53391165,  0.8577846 ,  0.18336855]])

It is also possible to convert a quaternion to or from a 3x3 array of floats representing a rotation matrix, or an array of N quaternions to or from an Nx3x3 array of floats representing N rotation matrices, using as_rotation_matrix and from_rotation_matrix. Similar conversions are possible for rotation vectors using as_rotation_vector and from_rotation_vector, and for spherical coordinates using as_spherical_coords and from_spherical_coords. Finally, it is possible to derive the Euler angles from a quaternion using as_euler_angles, or create a quaternion from Euler angles using from_euler_angles — though be aware that Euler angles are basically the worst things ever.¹ Before you complain about those functions using something other than your favorite conventions, please read this page.

Bug reports and feature requests

Bug reports and feature requests are entirely welcome (with very few exceptions). The best way to do this is to open an issue on this code's github page. For bug reports, please try to include a minimal working example demonstrating the problem.

Pull requests are also entirely welcome, of course, if you have an idea where the code is going wrong, or have an idea for a new feature that you know how to implement.

This code is routinely tested on recent versions of both python (3.8 though 3.11) and numpy (>=1.13). But the test coverage is not necessarily as complete as it could be, so bugs may certainly be present, especially in the higher-level functions like mean_rotor_....

Acknowledgments

This code is, of course, hosted on github. Because it is an open-source project, the hosting is free, and all the wonderful features of github are available, including free wiki space and web page hosting, pull requests, a nice interface to the git logs, etc. Github user Hannes Ovrén (hovren) pointed out some errors in a previous version of this code and suggested some nice utility functions for rotation matrices, etc. Github user Stijn van Drongelen (rhymoid) contributed some code that makes compilation work with MSVC++. Github user Jon Long (longjon) has provided some elegant contributions to substantially improve several tricky parts of this code. Rebecca Turner (9999years) and Leo Stein (duetosymmetry) did all the work in getting the documentation onto Read the Docs.

Every change in this code is automatically tested on Github Actions. The code is downloaded and installed fresh each time, and then tested, on each of the different supported versions of python, on each of the supported platforms. This ensures that no change I make to the code breaks either installation or any of the features that I have written tests for. Github Actions also automatically builds the pip versions of the code hosted on pypi. Conda-forge also uses Github Actions to build the conda/mamba version hosted on anaconda.org. These are all free services for open-source projects like this one.

The work of creating this code was supported in part by the Sherman Fairchild Foundation and by NSF Grants No. PHY-1306125 and AST-1333129.

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¹ Euler angles are awful

Euler angles are pretty much the worst things ever and it makes me feel bad even supporting them. Quaternions are faster, more accurate, basically free of singularities, more intuitive, and generally easier to understand. You can work entirely without Euler angles (I certainly do). You absolutely never need them. But if you really can't give them up, they are mildly supported.