Well, I know it's not the definitive source of anything, but the wikipedia entry on JPEG2000 says: "The PNG (Portable Network Graphics) format is still more space-efficient in the case of images with many pixels of the same color, and supports special compression features that JPEG 2000 does not." So would PNG be better? It does support 16 bit greyscale. Then again, so does TIFF, and Mar already uses that. Why don't they use the LZW compression feature of TIFF? The old Mar325 images were compressed after all. I think only Mar can answer this, but I imagine the choice to drop compression was because the advantages of compression (a factor or 2 or so in space) are outweighed by the disadvantages (limited speed and limited compatibility with data processing packages).

How good could lossless compression of diffraction images possibly be? I just ran an entropy calculation on the 44968 images on "/data" at the moment at ALS 8.3.1. I am using a feature of Andy Hammersley's program "FIT2D" to compute the entropy. I don't pretend to completely understand the algorithm, but I do understand that the entropy of the image reflects the maximum possible compression ratio. For these images, the "theoretical maximum compression ratio" ranged from 1.2 to 4.8 with mean 2.7 and standard deviation 0.7. The values for Huffmann encoding ranged from 0.95 to 4.7 with mean 2.4 and standard deviation 1.0. The correlation coefficient between the Huffmann and "theoretical" compression ratio was 0.97. I had a look at a few of the outlier cases. As one might expect, the best compression ratios are from blank images (where all the high-order bits are zero). The #1 hardest-to-compress image had many overloads, clear protein diffraction and a bunch of ice rings. So, unless I am missing something, I think the best we are going to get with lossless compression is about 2.5:1. At least, for individual frames. Compressing a data set as a "video" sequence might have substantial gains since only a few pixels change significantly from frame-to-frame. Are there any lossless video codecs out there? If so, can they handle 6144x6144 video?

What about lossy compression? Yes yes, I know it sounds like a horrible idea to use lossy compression on scientific data, because it would change the values of that most precious of numbers: Fobs. However, the question I have never heard a good answer to is HOW MUCH would it change Fobs? More practically: how much compression can you do before Fobs changes by more than the value of SIGFobs? Diffraction patterns are inherently noisy. If you take the same image twice, then photon counting statistics make sure that no two images are exactly the same. So which one is "right"? If the changes in pixel values from a lossy compression algorithm are always smaller than that introduced by photon-counting noise, then is lossy compression really such a bad idea? The errors introduced could be small when compared to errors in say, scale factors or bulk solvent parameters. A great deal can be gained in compression ratio if only "random noise" is removed. I remember the days before MP3 when it was lamented that sampled audio files could never be compressed very well. Even today bzip2 does not work very well at all at compressing sampled audio (about 1.3:1), but mp3 files can be made at a "compression ratio" of 10:1 over CD-quality audio and we all seem to still enjoy the music.

I suppose the best "lossy compression" is the one that preserves the features of the image you want and throws out the stuff you don't care about. So, in a way, data-reduction programs are probably the best "lossy compression" we are going to get. Unfortunately, accurate "external information" is required (such as the beam center convention!), so the interface to this "compression algorithm" still a little more complicated than pkzip. ;)

Nevertheless, there are still only about 40-50 "formats" of diffraction images floating around (30 operating beamlines, a few in-house vendors and some "history"). I would like to collect them all. So, if anybody out there has a lysozyme data set (or even just a single image) from anywhere but ALS 8.3.1, please let me know how I can get a copy of it!

-James Holton
MAD Scientist


Harry Powell wrote:
Hi

Just to add to this. imgCIF (or CBF, which amounts to pretty well the same thing) has fast and efficient compression built in, and has been developed with protein crystallography (particularly) in mind. There are even (a few) detectors out there which will write these instead of (or as well as) the manufacturer's native format, saving the user the trouble of conversion.

If you're looking for a standard format for storing image data in, I wouldn't look any further, since (in principle) imgCIF/CBF can store all the image information you (or a fussy^H^H^H^H^H conscientious reviewer who could be bothered to re-process your dataset) would want about your data collection and you wouldn't need to come up with inventive tags for data items that might be required for other (general purpose) image formats.

There are even conversion programs available to convert to imgCIF/CBF files from some native formats - if your favourite detector isn't one of these, drop Herb Bernstein a line and ask for support ;-)

I looked at jpeg2000 as a compression for diffraction images for
archiving purposes - it works well but is *SLOW*. It's designed with the
idea in mind of compressing a single image, not the several hundred
typical for our work. There is also no place to put the header.

Bzip2 works pretty much as well and is standard, but again slow. This is
what people mostly seem to use for putting diffraction images on the
web, particularly the JCSG.

The ccp4 "pack" format which has been around for a very long time works
very well and is jolly quick, and is supported in a number of data
processing packages natively (Mosflm, XDS). Likewise there is a new
compression being used for the Pilatus detector which is quicker again.
These two have the advantage of being designed for diffraction images
and with speed in mind.

So there are plenty of good compression schemes out there - and if you
use CBF these can be supported natively in the image standard... So you
don't even need to know or care...

Just my 2c on this one.

Cheers,

Graeme

-----Original Message-----
From: CCP4 bulletin board [mailto:[EMAIL PROTECTED] On Behalf Of
Maneesh Yadav
Sent: 18 August 2007 00:02
To: CCP4BB@JISCMAIL.AC.UK
Subject: [ccp4bb] diffraction images images/jpeg2000

FWIW, I don't agree with storing image data, I don't think they justify
the cost of storage even remotely (some people debate the value of the
structures themselves....)...but if you want to do it anyway, maybe we
should use a format like jpeg2000.

Last time I checked, none of the major image processing suites used it,
but it is a very impressive and mature format that (I think) would be
suitable for diffraction images.  If anyone is up for experimenting, you
can get a nice suite of tools from kakadu (just google kakdu +
jpeg2000).


Harry

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