[cctbxbb] repr for flex arrays

[email protected] Graeme.Winter at diamond.ac.uk
Fri Sep 14 11:08:30 PDT 2018


Hi Aaron

Yes I think this would be useful. I’d perhaps be more permissive say printing 10 or fewer items, but this is is the direction

The numpy illustration I gave was an unfortunate choice.

Thanks Graeme

On 14 Sep 2018, at 19:01, Aaron Brewster <asbrewster at lbl.gov<mailto:asbrewster at lbl.gov>> wrote:

Hi, I think avoiding a copy is good.  What about this:

Flex type <type(a)>, focus: <a.focus()>, size: <len(a)> memory address <address>, first and last element if len(a)>0: <a[0]>, <a[-1]>

Like numpy does, let's avoid printing every element.

On Fri, Sep 14, 2018 at 10:50 AM Nicholas Sauter <nksauter at lbl.gov<mailto:nksauter at lbl.gov>> wrote:
Yes, there is a philosophical objection to using .as_numpy_array().  Numpy only deals with a fixed number of data types, such as int, double, etc.  Flex arrays can be extended to many other types such as Bragg spots, 2-vectors, 3-vectors, and 3x3 matrices.  Therefore, if we are going to take the performance hit and do a copy, I would simply recommend using a Python list:

__repr__(a) :== list(a)

Nick

Nicholas K. Sauter, Ph. D.
Senior Scientist, Molecular Biophysics & Integrated Bioimaging Division
Lawrence Berkeley National Laboratory
1 Cyclotron Rd., Bldg. 33R0345
Berkeley, CA 94720
(510) 486-5713

On Fri, Sep 14, 2018 at 9:56 AM, Nicholas Devenish <ndevenish at gmail.com<mailto:ndevenish at gmail.com>> wrote:
I think as_numpy_array was just a suggestion of the simplest possible
starting implementation.

But is there a philosophical objection to them being added?

Nick

On Fri, Sep 14, 2018 at 5:27 PM Graeme.Winter at Diamond.ac.uk<mailto:Graeme.Winter at Diamond.ac.uk>
<Graeme.Winter at diamond.ac.uk<mailto:Graeme.Winter at diamond.ac.uk>> wrote:
>
> Does it? Dang! Thought it would be fly weight and just make the data structures needed.
>
> If that’s the case then completely agree.
>
> Cheers Graeme
> ________________________________
> From: cctbxbb-bounces at phenix-online.org<mailto:cctbxbb-bounces at phenix-online.org> <cctbxbb-bounces at phenix-online.org<mailto:cctbxbb-bounces at phenix-online.org>> on behalf of Aaron Brewster <asbrewster at lbl.gov<mailto:asbrewster at lbl.gov>>
> Sent: 14 September 2018 17:23:41
> To: cctbx mailing list
> Subject: Re: [cctbxbb] repr for flex arrays
>
> Hi Graeme, I'm not sure what the right answer here is except I don't think it is as_numpy_array().__repr__ as that does a copy.  No good for big arrays.
>
>
>
>
> On Fri, Sep 14, 2018 at 7:30 AM Graeme.Winter at Diamond.ac.uk<mailto:Graeme.Winter at Diamond.ac.uk><mailto:Graeme.Winter at Diamond.ac.uk<mailto:Graeme.Winter at Diamond.ac.uk>> <Graeme.Winter at diamond.ac.uk<mailto:Graeme.Winter at diamond.ac.uk><mailto:Graeme.Winter at diamond.ac.uk<mailto:Graeme.Winter at diamond.ac.uk>>> wrote:
> Hi Folks,
>
> Is there a reason for not having a helpful __repr__ for flex arrays i.e.
>
> Grey-Area:002-decide-when graeme$ dials.python
> Python 2.7.14 (default, Apr 17 2018, 15:02:10)
> [GCC 4.2.1 Compatible Apple LLVM 9.1.0 (clang-902.0.39.1)] on darwin
> Type "help", "copyright", "credits" or "license" for more information.
> >>> from dials.array_family import flex
> >>> a = flex.double([1, 2, 3])
> >>> print a
> <scitbx_array_family_flex_ext.double object at 0x1095673c0>
>
> (I have a feeling I asked this before but cannot find reference)
>
> For example
>
> >>> print a.as_numpy_array()
> [ 1.  2.  3.]
>
> is more useful… but annoying to type
>
> I appreciate a could be “big” but numpy seems to handle this OK
>
> even - could __repr__ be punned to as_numpy_array(),__repr__()?
>
> Currently it prints the type of the array and its location in ram, which are adequately served by
>
> >>> type(a)
> <class 'scitbx_array_family_flex_ext.double'>
> >>> print id(a)
> 4451627968
>
> If I print an array I more often want to see the content and less often the storage class and location (I humbly assert)
>
> Thoughts? I know this tends to confuse and annoy people who are new to flex arrays (and veterans who are busy debugging stuff…)
>
> Many thanks Graeme
>
>
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