Re: [ccp4bb] while on the subject of stereo

2011-03-23 Thread Anastassis Perrakis
To add my two cents, I am not at all a fun of stereo for routine use,  
but I appreciate it if I have to look at a long ligand bent 90 deg in  
the middle to bury in my protein, and all that at 3.0-3.5 A  
resolution ... So, I must have both types of brain damage that Jan  
refers to. No surprises here I guess.


A.

On Mar 23, 2011, at 3:16, Phoebe Rice wrote:


My 2 cents worth on the stereo-dependent:

1) They have carpal tunnel syndrome that makes it painful to keep  
the molecule in motion while rebuilding it (NOTE: enough constant  
mouse-wiggling and you will get carpal tunnel problems if you don't  
have them yet!)


2) They work on big, low-resolution structures where you need to see  
a bigger-picture view.  I've had people tell me that can fit 3-3.5A  
maps just fine without stereo, but having viewed their work, I beg  
to differ.


 Phoebe

 Original message 

Date: Tue, 1 Mar 2011 22:30:54 +
From: CCP4 bulletin board CCP4BB@JISCMAIL.AC.UK (on behalf of Jan  
Löwe j...@mrc-lmb.cam.ac.uk)

Subject: Re: [ccp4bb] while on the subject of stereo
To: CCP4BB@JISCMAIL.AC.UK

Ah! The question of to stereo or not to stereo! There has to be a
scientific reason why this question is more popular than asking for  
what
Linux distro is more fashionable this spring or why an Rmerge of  
0.90 in

the outermost shell is good for you and your structure.

I am offering my two (conflicting) theories (and apologies that both
seem to imply some problem):

A) people who do use stereo have a problem with their brain because  
they

cannot produce three dimensional vision from depth cues alone.

B) people who do not use stereo have a problem with their brain  
because
they cannot see properly in three dimensions and rely on depth cues  
alone.


I personally prefer people with A) when I am their passenger in a car
since they do not need to rotate by 90° to see how far the braking
lights of the car in front are away :-)

jan



On 01/03/2011 21:35, Jim Pflugrath wrote:

I will offer my view.

I hate stereo glasses and hate stereo in general.

One should be able to see 3D from the depth-cueing and by keeping  
the view
in motion.  For fitting, I like to flip the view by 90 degrees.  I  
know I am
going to move in displayX and displayY, but never in displayZ.  I  
then
rotate the view around the vertical axis so thatn the old displayZ  
becomes

displayX.

Furthermore, I don't waste too much time fitting.  I know the  
software can
fit the map better than me, so I let it do its job.  I only need  
to get the
coordinates within the radius of convergence of the refinement  
program.  I
also know that 9 times out of 10, the displayed electron density  
is probably
suspect, so I believe in stereochemistry more than I believe in  
the map.


The main trick is to realize that as a human being, you really are  
not that
good at fitting the map or that it is unnecessary to waste your  
time since
the software is really so much better than you.  Refinement is  
quick enough
that you can try various hypotheses as in:  If I move this here,  
then
refinement will do the trick and Well, that didn't work, so I  
will move

that over there and see if refinement will do the trick.

As for stereo figures, you should be able to convey what you want  
to say
from a good figure with depth-cueing, shadows, etc.  Don't ever  
use stereo
glasses in a public seminar.  Maybe my opinion will change with  
better

stereo technology.

OK, I know quite a lot of people will disagree with me. :)

Jim

-Original Message-
From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf  
Of David

Roberts
Sent: Tuesday, March 01, 2011 10:29 AM
To: CCP4BB@JISCMAIL.AC.UK
Subject: [ccp4bb] while on the subject of stereo

Hi again,

I'd like to ask a question about the pedagogy of stereo.  That is,  
using

stereo with students in the classroom.

Do you all find that, after setting up these elaborate stereo  
devices,

students really use the stereo or do they tend not to?

I am a huge fan of stereo - and frankly here we have quite a few  
options for
doing stereo - from the active Nvidia systems that people have  
recently been

discussing to passive zalmans. ...

As I mentioned, I like stereo a lot, but really projecting on a  
nice bright
lcd monitor also has it's advantages, and with the ease of moving  
things
using the mouse (or whatever device you use), the overall need for  
stereo
seems to be decreasing.  I don't know - I just wonder what peoples  
views are
out there for the actual need for stereo.  It's incredibly cool  
- and I
think is a very powerful way to show things - but I'm wondering if  
we focus

too much on it because it's cool and not because it's pedagogically
necessary.

Just wondering, no worries.  Thanks

Dave


P please don't print this e-mail unless you really need to
Anastassis (Tassos) Perrakis, Principal Investigator / Staff Member
Department of Biochemistry (B8)
Netherlands Cancer Institute,
Dept

Re: [ccp4bb] while on the subject of stereo

2011-03-23 Thread Jürgen Bosch
I never thought I would agree with Tassos :-)
But same experience 3D and wiggling with a snaked ligand makes live so much 
easier.
It helps to have a fast graphics card though.
Jürgen 

..
Jürgen Bosch
Johns Hopkins Bloomberg School of Public Health
Department of Biochemistry  Molecular Biology
Johns Hopkins Malaria Research Institute
615 North Wolfe Street, W8708
Baltimore, MD 21205
Phone: +1-410-614-4742
Lab:  +1-410-614-4894
Fax:  +1-410-955-3655
http://web.mac.com/bosch_lab/

On Mar 23, 2011, at 4:21, Anastassis Perrakis a.perra...@nki.nl wrote:

 To add my two cents, I am not at all a fun of stereo for routine use, but I 
 appreciate it if I have to look at a long ligand bent 90 deg in the middle to 
 bury in my protein, and all that at 3.0-3.5 A resolution ... So, I must have 
 both types of brain damage that Jan refers to. No surprises here I guess.
 
   A.
 
 On Mar 23, 2011, at 3:16, Phoebe Rice wrote:
 
 My 2 cents worth on the stereo-dependent:
 
 1) They have carpal tunnel syndrome that makes it painful to keep the 
 molecule in motion while rebuilding it (NOTE: enough constant mouse-wiggling 
 and you will get carpal tunnel problems if you don't have them yet!)
 
 2) They work on big, low-resolution structures where you need to see a 
 bigger-picture view.  I've had people tell me that can fit 3-3.5A maps just 
 fine without stereo, but having viewed their work, I beg to differ.
 
  Phoebe
 
  Original message 
 Date: Tue, 1 Mar 2011 22:30:54 +
 From: CCP4 bulletin board CCP4BB@JISCMAIL.AC.UK (on behalf of Jan Löwe 
 j...@mrc-lmb.cam.ac.uk)
 Subject: Re: [ccp4bb] while on the subject of stereo  
 To: CCP4BB@JISCMAIL.AC.UK
 
 Ah! The question of to stereo or not to stereo! There has to be a 
 scientific reason why this question is more popular than asking for what 
 Linux distro is more fashionable this spring or why an Rmerge of 0.90 in 
 the outermost shell is good for you and your structure.
 
 I am offering my two (conflicting) theories (and apologies that both 
 seem to imply some problem):
 
 A) people who do use stereo have a problem with their brain because they 
 cannot produce three dimensional vision from depth cues alone.
 
 B) people who do not use stereo have a problem with their brain because 
 they cannot see properly in three dimensions and rely on depth cues alone.
 
 I personally prefer people with A) when I am their passenger in a car 
 since they do not need to rotate by 90° to see how far the braking 
 lights of the car in front are away :-)
 
 jan
 
 
 
 On 01/03/2011 21:35, Jim Pflugrath wrote:
 I will offer my view.
 
 I hate stereo glasses and hate stereo in general.
 
 One should be able to see 3D from the depth-cueing and by keeping the view
 in motion.  For fitting, I like to flip the view by 90 degrees.  I know I 
 am
 going to move in displayX and displayY, but never in displayZ.  I then
 rotate the view around the vertical axis so thatn the old displayZ becomes
 displayX.
 
 Furthermore, I don't waste too much time fitting.  I know the software can
 fit the map better than me, so I let it do its job.  I only need to get the
 coordinates within the radius of convergence of the refinement program.  I
 also know that 9 times out of 10, the displayed electron density is 
 probably
 suspect, so I believe in stereochemistry more than I believe in the map.
 
 The main trick is to realize that as a human being, you really are not that
 good at fitting the map or that it is unnecessary to waste your time since
 the software is really so much better than you.  Refinement is quick enough
 that you can try various hypotheses as in:  If I move this here, then
 refinement will do the trick and Well, that didn't work, so I will move
 that over there and see if refinement will do the trick.
 
 As for stereo figures, you should be able to convey what you want to say
 from a good figure with depth-cueing, shadows, etc.  Don't ever use stereo
 glasses in a public seminar.  Maybe my opinion will change with better
 stereo technology.
 
 OK, I know quite a lot of people will disagree with me. :)
 
 Jim
 
 -Original Message-
 From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of David
 Roberts
 Sent: Tuesday, March 01, 2011 10:29 AM
 To: CCP4BB@JISCMAIL.AC.UK
 Subject: [ccp4bb] while on the subject of stereo
 
 Hi again,
 
 I'd like to ask a question about the pedagogy of stereo.  That is, using
 stereo with students in the classroom.
 
 Do you all find that, after setting up these elaborate stereo devices,
 students really use the stereo or do they tend not to?
 
 I am a huge fan of stereo - and frankly here we have quite a few options 
 for
 doing stereo - from the active Nvidia systems that people have recently 
 been
 discussing to passive zalmans. ...
 
 As I mentioned, I like stereo a lot, but really projecting on a nice bright
 lcd monitor also has it's advantages, and with the ease of moving things
 using

Re: [ccp4bb] while on the subject of stereo

2011-03-23 Thread Christoph Parthier

Hi Dave,

We recently equipped  a pool of 25 computers with Nvidia 3D shutter 
glasses, they're used in structural biology courses for undergraduate 
students of biochemistry . We teach mainly PyMOL, but (in an advanced 
course) also model building in COOT. Of course, we let the students 
decide whether they want to use hardware stereo or not. They all try. 
After several courses now I realized no more than 30% of the students 
keep using them in visualization and model building, while the majority 
of students put the glasses aside... Some of the 30% said, it helps, but 
could also do without. Haven't assessed this properly yet... ;-)


Christoph


David Roberts wrote:
Thanks for the comments, I do appreciate them.  I guess we went off in 
a direction I wasn't thinking of - related to your personal like or 
dislike of stereo.  What I am really looking for is an answer to a 
simple question in that is stereo a nice thing from a pedagogy 
standpoint for showing students complex biomolecules.


I am in a chemistry department - undergraduate only.  We focus on 
3-dimensional shape and the importance of shape of chemical 
function/reactivity/etc...  With small molecules (PF5, etc...), it's 
easy to see how shape works by simply rotating the molecule.  The 
molecules are small enough, the concept of 3D can be visualized easily 
in these systems.  Furthermore, they can make a simple model using 
your standard organic or inorganic model kit, no worries.


Now, bring in a huge protein, or a protein-protein complex.  The issue 
of 3Dness becomes fuzzier.  It's not so easy to see which hydrogen 
will get plucked off during a chemical reaction, even with careful 
zooming and mouse manipulation.  So my question still is, how many of 
you feel stereo is important from a pedagogy standpoint (not looking 
at maps, just structures that are huge and complex).  Is it something 
that we need to try to bring to the classroom, or is it just a cool 
toy like the 3D TV that hopefully is going nowhere and will soon fade 
out like the viewmaster of old.  I know a large percentage of people 
cannot see stereo (at least the way we present it), and so it isn't 
for everybody.  But, does it help, and if so, does it help when done 
in a huge classroom or when put on an individual screen.  Has anybody 
tried to assess this (there's a horrible word for you).


That's what I was wondering about.  Presenting the stereo is a 
different issue (how is that done), but I think there are lots of 
avenues for that depending on your particular situation.


Thanks again

Dave


Re: [ccp4bb] while on the subject of stereo

2011-03-23 Thread Jürgen Bosch
I think the weight of the shutter glasses puts them off. Compared to the 30g or 
less of the Zalmans the shutter glasses  feel like bricks. I would estimate 
them to at least 270g. After one hour wearing them you feel them on your nose.
Jürgen 

..
Jürgen Bosch
Johns Hopkins Bloomberg School of Public Health
Department of Biochemistry  Molecular Biology
Johns Hopkins Malaria Research Institute
615 North Wolfe Street, W8708
Baltimore, MD 21205
Phone: +1-410-614-4742
Lab:  +1-410-614-4894
Fax:  +1-410-955-3655
http://web.mac.com/bosch_lab/

On Mar 23, 2011, at 9:40, Christoph Parthier cparth...@googlemail.com wrote:

 Hi Dave,
 
 We recently equipped  a pool of 25 computers with Nvidia 3D shutter 
 glasses, they're used in structural biology courses for undergraduate 
 students of biochemistry . We teach mainly PyMOL, but (in an advanced 
 course) also model building in COOT. Of course, we let the students 
 decide whether they want to use hardware stereo or not. They all try. 
 After several courses now I realized no more than 30% of the students 
 keep using them in visualization and model building, while the majority 
 of students put the glasses aside... Some of the 30% said, it helps, but 
 could also do without. Haven't assessed this properly yet... ;-)
 
 Christoph
 
 
 David Roberts wrote:
 Thanks for the comments, I do appreciate them.  I guess we went off in 
 a direction I wasn't thinking of - related to your personal like or 
 dislike of stereo.  What I am really looking for is an answer to a 
 simple question in that is stereo a nice thing from a pedagogy 
 standpoint for showing students complex biomolecules.
 
 I am in a chemistry department - undergraduate only.  We focus on 
 3-dimensional shape and the importance of shape of chemical 
 function/reactivity/etc...  With small molecules (PF5, etc...), it's 
 easy to see how shape works by simply rotating the molecule.  The 
 molecules are small enough, the concept of 3D can be visualized easily 
 in these systems.  Furthermore, they can make a simple model using 
 your standard organic or inorganic model kit, no worries.
 
 Now, bring in a huge protein, or a protein-protein complex.  The issue 
 of 3Dness becomes fuzzier.  It's not so easy to see which hydrogen 
 will get plucked off during a chemical reaction, even with careful 
 zooming and mouse manipulation.  So my question still is, how many of 
 you feel stereo is important from a pedagogy standpoint (not looking 
 at maps, just structures that are huge and complex).  Is it something 
 that we need to try to bring to the classroom, or is it just a cool 
 toy like the 3D TV that hopefully is going nowhere and will soon fade 
 out like the viewmaster of old.  I know a large percentage of people 
 cannot see stereo (at least the way we present it), and so it isn't 
 for everybody.  But, does it help, and if so, does it help when done 
 in a huge classroom or when put on an individual screen.  Has anybody 
 tried to assess this (there's a horrible word for you).
 
 That's what I was wondering about.  Presenting the stereo is a 
 different issue (how is that done), but I think there are lots of 
 avenues for that depending on your particular situation.
 
 Thanks again
 
 Dave


Re: [ccp4bb] while on the subject of stereo

2011-03-23 Thread Christoph Parthier
Those must be older ones... The current Nvidia shutter glasses we use 
are about 50g.

http://www.nvidia.co.uk/object/product_GeForce_3D_VisionKit_uk.html

Christoph


Jürgen Bosch wrote:

I think the weight of the shutter glasses puts them off. Compared to the 30g or 
less of the Zalmans the shutter glasses  feel like bricks. I would estimate 
them to at least 270g. After one hour wearing them you feel them on your nose.
Jürgen

..
Jürgen Bosch
Johns Hopkins Bloomberg School of Public Health
Department of Biochemistry  Molecular Biology
Johns Hopkins Malaria Research Institute
615 North Wolfe Street, W8708
Baltimore, MD 21205
Phone: +1-410-614-4742
Lab:  +1-410-614-4894
Fax:  +1-410-955-3655
http://web.mac.com/bosch_lab/

On Mar 23, 2011, at 9:40, Christoph Parthiercparth...@googlemail.com  wrote:

   

Hi Dave,

We recently equipped  a pool of 25 computers with Nvidia 3D shutter
glasses, they're used in structural biology courses for undergraduate
students of biochemistry . We teach mainly PyMOL, but (in an advanced
course) also model building in COOT. Of course, we let the students
decide whether they want to use hardware stereo or not. They all try.
After several courses now I realized no more than 30% of the students
keep using them in visualization and model building, while the majority
of students put the glasses aside... Some of the 30% said, it helps, but
could also do without. Haven't assessed this properly yet... ;-)

Christoph


David Roberts wrote:
 

Thanks for the comments, I do appreciate them.  I guess we went off in
a direction I wasn't thinking of - related to your personal like or
dislike of stereo.  What I am really looking for is an answer to a
simple question in that is stereo a nice thing from a pedagogy
standpoint for showing students complex biomolecules.

I am in a chemistry department - undergraduate only.  We focus on
3-dimensional shape and the importance of shape of chemical
function/reactivity/etc...  With small molecules (PF5, etc...), it's
easy to see how shape works by simply rotating the molecule.  The
molecules are small enough, the concept of 3D can be visualized easily
in these systems.  Furthermore, they can make a simple model using
your standard organic or inorganic model kit, no worries.

Now, bring in a huge protein, or a protein-protein complex.  The issue
of 3Dness becomes fuzzier.  It's not so easy to see which hydrogen
will get plucked off during a chemical reaction, even with careful
zooming and mouse manipulation.  So my question still is, how many of
you feel stereo is important from a pedagogy standpoint (not looking
at maps, just structures that are huge and complex).  Is it something
that we need to try to bring to the classroom, or is it just a cool
toy like the 3D TV that hopefully is going nowhere and will soon fade
out like the viewmaster of old.  I know a large percentage of people
cannot see stereo (at least the way we present it), and so it isn't
for everybody.  But, does it help, and if so, does it help when done
in a huge classroom or when put on an individual screen.  Has anybody
tried to assess this (there's a horrible word for you).

That's what I was wondering about.  Presenting the stereo is a
different issue (how is that done), but I think there are lots of
avenues for that depending on your particular situation.

Thanks again

Dave
   


Re: [ccp4bb] while on the subject of stereo

2011-03-22 Thread Phoebe Rice
My 2 cents worth on the stereo-dependent:

1) They have carpal tunnel syndrome that makes it painful to keep the molecule 
in motion while rebuilding it (NOTE: enough constant mouse-wiggling and you 
will get carpal tunnel problems if you don't have them yet!)

2) They work on big, low-resolution structures where you need to see a 
bigger-picture view.  I've had people tell me that can fit 3-3.5A maps just 
fine without stereo, but having viewed their work, I beg to differ.

  Phoebe

 Original message 
Date: Tue, 1 Mar 2011 22:30:54 +
From: CCP4 bulletin board CCP4BB@JISCMAIL.AC.UK (on behalf of Jan Löwe 
j...@mrc-lmb.cam.ac.uk)
Subject: Re: [ccp4bb] while on the subject of stereo  
To: CCP4BB@JISCMAIL.AC.UK

Ah! The question of to stereo or not to stereo! There has to be a 
scientific reason why this question is more popular than asking for what 
Linux distro is more fashionable this spring or why an Rmerge of 0.90 in 
the outermost shell is good for you and your structure.

I am offering my two (conflicting) theories (and apologies that both 
seem to imply some problem):

A) people who do use stereo have a problem with their brain because they 
cannot produce three dimensional vision from depth cues alone.

B) people who do not use stereo have a problem with their brain because 
they cannot see properly in three dimensions and rely on depth cues alone.

I personally prefer people with A) when I am their passenger in a car 
since they do not need to rotate by 90° to see how far the braking 
lights of the car in front are away :-)

jan



On 01/03/2011 21:35, Jim Pflugrath wrote:
 I will offer my view.

 I hate stereo glasses and hate stereo in general.

 One should be able to see 3D from the depth-cueing and by keeping the view
 in motion.  For fitting, I like to flip the view by 90 degrees.  I know I am
 going to move in displayX and displayY, but never in displayZ.  I then
 rotate the view around the vertical axis so thatn the old displayZ becomes
 displayX.

 Furthermore, I don't waste too much time fitting.  I know the software can
 fit the map better than me, so I let it do its job.  I only need to get the
 coordinates within the radius of convergence of the refinement program.  I
 also know that 9 times out of 10, the displayed electron density is probably
 suspect, so I believe in stereochemistry more than I believe in the map.

 The main trick is to realize that as a human being, you really are not that
 good at fitting the map or that it is unnecessary to waste your time since
 the software is really so much better than you.  Refinement is quick enough
 that you can try various hypotheses as in:  If I move this here, then
 refinement will do the trick and Well, that didn't work, so I will move
 that over there and see if refinement will do the trick.

 As for stereo figures, you should be able to convey what you want to say
 from a good figure with depth-cueing, shadows, etc.  Don't ever use stereo
 glasses in a public seminar.  Maybe my opinion will change with better
 stereo technology.

 OK, I know quite a lot of people will disagree with me. :)

 Jim

 -Original Message-
 From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of David
 Roberts
 Sent: Tuesday, March 01, 2011 10:29 AM
 To: CCP4BB@JISCMAIL.AC.UK
 Subject: [ccp4bb] while on the subject of stereo

 Hi again,

 I'd like to ask a question about the pedagogy of stereo.  That is, using
 stereo with students in the classroom.

 Do you all find that, after setting up these elaborate stereo devices,
 students really use the stereo or do they tend not to?

 I am a huge fan of stereo - and frankly here we have quite a few options for
 doing stereo - from the active Nvidia systems that people have recently been
 discussing to passive zalmans. ...

 As I mentioned, I like stereo a lot, but really projecting on a nice bright
 lcd monitor also has it's advantages, and with the ease of moving things
 using the mouse (or whatever device you use), the overall need for stereo
 seems to be decreasing.  I don't know - I just wonder what peoples views are
 out there for the actual need for stereo.  It's incredibly cool - and I
 think is a very powerful way to show things - but I'm wondering if we focus
 too much on it because it's cool and not because it's pedagogically
 necessary.

 Just wondering, no worries.  Thanks

 Dave


Re: [ccp4bb] while on the subject of stereo

2011-03-22 Thread Mayer, Mark (NIH/NICHD) [E]
what about the fashion statement made by cool glasses?

From: Phoebe Rice [pr...@uchicago.edu]
Sent: Tuesday, March 22, 2011 10:16 PM
To: CCP4BB@JISCMAIL.AC.UK
Subject: Re: [ccp4bb] while on the subject of stereo

My 2 cents worth on the stereo-dependent:

1) They have carpal tunnel syndrome that makes it painful to keep the molecule 
in motion while rebuilding it (NOTE: enough constant mouse-wiggling and you 
will get carpal tunnel problems if you don't have them yet!)

2) They work on big, low-resolution structures where you need to see a 
bigger-picture view.  I've had people tell me that can fit 3-3.5A maps just 
fine without stereo, but having viewed their work, I beg to differ.

  Phoebe

 Original message 
Date: Tue, 1 Mar 2011 22:30:54 +
From: CCP4 bulletin board CCP4BB@JISCMAIL.AC.UK (on behalf of Jan Löwe 
j...@mrc-lmb.cam.ac.uk)
Subject: Re: [ccp4bb] while on the subject of stereo
To: CCP4BB@JISCMAIL.AC.UK

Ah! The question of to stereo or not to stereo! There has to be a
scientific reason why this question is more popular than asking for what
Linux distro is more fashionable this spring or why an Rmerge of 0.90 in
the outermost shell is good for you and your structure.

I am offering my two (conflicting) theories (and apologies that both
seem to imply some problem):

A) people who do use stereo have a problem with their brain because they
cannot produce three dimensional vision from depth cues alone.

B) people who do not use stereo have a problem with their brain because
they cannot see properly in three dimensions and rely on depth cues alone.

I personally prefer people with A) when I am their passenger in a car
since they do not need to rotate by 90° to see how far the braking
lights of the car in front are away :-)

jan



On 01/03/2011 21:35, Jim Pflugrath wrote:
 I will offer my view.

 I hate stereo glasses and hate stereo in general.

 One should be able to see 3D from the depth-cueing and by keeping the view
 in motion.  For fitting, I like to flip the view by 90 degrees.  I know I am
 going to move in displayX and displayY, but never in displayZ.  I then
 rotate the view around the vertical axis so thatn the old displayZ becomes
 displayX.

 Furthermore, I don't waste too much time fitting.  I know the software can
 fit the map better than me, so I let it do its job.  I only need to get the
 coordinates within the radius of convergence of the refinement program.  I
 also know that 9 times out of 10, the displayed electron density is probably
 suspect, so I believe in stereochemistry more than I believe in the map.

 The main trick is to realize that as a human being, you really are not that
 good at fitting the map or that it is unnecessary to waste your time since
 the software is really so much better than you.  Refinement is quick enough
 that you can try various hypotheses as in:  If I move this here, then
 refinement will do the trick and Well, that didn't work, so I will move
 that over there and see if refinement will do the trick.

 As for stereo figures, you should be able to convey what you want to say
 from a good figure with depth-cueing, shadows, etc.  Don't ever use stereo
 glasses in a public seminar.  Maybe my opinion will change with better
 stereo technology.

 OK, I know quite a lot of people will disagree with me. :)

 Jim

 -Original Message-
 From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of David
 Roberts
 Sent: Tuesday, March 01, 2011 10:29 AM
 To: CCP4BB@JISCMAIL.AC.UK
 Subject: [ccp4bb] while on the subject of stereo

 Hi again,

 I'd like to ask a question about the pedagogy of stereo.  That is, using
 stereo with students in the classroom.

 Do you all find that, after setting up these elaborate stereo devices,
 students really use the stereo or do they tend not to?

 I am a huge fan of stereo - and frankly here we have quite a few options for
 doing stereo - from the active Nvidia systems that people have recently been
 discussing to passive zalmans. ...

 As I mentioned, I like stereo a lot, but really projecting on a nice bright
 lcd monitor also has it's advantages, and with the ease of moving things
 using the mouse (or whatever device you use), the overall need for stereo
 seems to be decreasing.  I don't know - I just wonder what peoples views are
 out there for the actual need for stereo.  It's incredibly cool - and I
 think is a very powerful way to show things - but I'm wondering if we focus
 too much on it because it's cool and not because it's pedagogically
 necessary.

 Just wondering, no worries.  Thanks

 Dave


Re: [ccp4bb] while on the subject of stereo

2011-03-22 Thread Richard Edward Gillilan
There are actually a bunch of depth cues that humans use to perceive 
3-dimensionality.  Existing computer displays only reproduce a few. Because of  
redundancy, people can function with only a subset, but it can be a serious 
handicap. Individuals who are stereoblind can learn to judge distances (such as 
how far away a stop sign is) from the sizes of familiar objects and other cues 
... but it doesn't work that well.  Conflicting depth cues are one thing that 
causes motion sickness. 

Rocking or rotating an image is a type of depth cue. Perspective is a depth 
cue.  Lighting effects, such as fading the brightness of an object  with 
distance or placing an object in fog are also depth cues. Focus is a depth due, 
and so is convergence of the eyes ... neither of those are reproduced by 
current computer graphics displays (except perhaps experimental ones). There is 
more to that list.

A fair number of people have poor stereo vision ... some don't even realize it. 
It does not help that stereo systems are sometimes poorly adjusted and 
sometimes not even done mathematically correctly.  Proper stereo 
transformations require that you know where the person's eyes are located with 
respect to the screen.

A number of years ago, when I ran Cornell's virtual reality CAVE, one visitor 
told me he was stereo blind and so would not get much out of the experience. 
But something very unusual happened: when he put on the glasses and motion 
tracking system, he was apparently able to see stereo for the first time. 
Perhaps it was something to do with some misalignment in our system that 
compensated for his vision problem. Anyhow, it was a remarkable experience for 
him. 

I've fit density with and without stereo, and personally, I find that stereo 
adds a great deal. It's not everything, but why throw out a perfectly good 
depth cue and work stereoblind?

It will be interesting to see if the current trend in stereo movies  and 3D TV 
continues or fizzles (as it did in the 50's). 

Richard Gillilan
MacCHESS


On Mar 22, 2011, at 11:01 PM, Mayer, Mark (NIH/NICHD) [E] wrote:

 what about the fashion statement made by cool glasses?
 
 From: Phoebe Rice [pr...@uchicago.edu]
 Sent: Tuesday, March 22, 2011 10:16 PM
 To: CCP4BB@JISCMAIL.AC.UK
 Subject: Re: [ccp4bb] while on the subject of stereo
 
 My 2 cents worth on the stereo-dependent:
 
 1) They have carpal tunnel syndrome that makes it painful to keep the 
 molecule in motion while rebuilding it (NOTE: enough constant mouse-wiggling 
 and you will get carpal tunnel problems if you don't have them yet!)
 
 2) They work on big, low-resolution structures where you need to see a 
 bigger-picture view.  I've had people tell me that can fit 3-3.5A maps just 
 fine without stereo, but having viewed their work, I beg to differ.
 
  Phoebe
 
  Original message 
 Date: Tue, 1 Mar 2011 22:30:54 +
 From: CCP4 bulletin board CCP4BB@JISCMAIL.AC.UK (on behalf of Jan Löwe 
 j...@mrc-lmb.cam.ac.uk)
 Subject: Re: [ccp4bb] while on the subject of stereo
 To: CCP4BB@JISCMAIL.AC.UK
 
 Ah! The question of to stereo or not to stereo! There has to be a
 scientific reason why this question is more popular than asking for what
 Linux distro is more fashionable this spring or why an Rmerge of 0.90 in
 the outermost shell is good for you and your structure.
 
 I am offering my two (conflicting) theories (and apologies that both
 seem to imply some problem):
 
 A) people who do use stereo have a problem with their brain because they
 cannot produce three dimensional vision from depth cues alone.
 
 B) people who do not use stereo have a problem with their brain because
 they cannot see properly in three dimensions and rely on depth cues alone.
 
 I personally prefer people with A) when I am their passenger in a car
 since they do not need to rotate by 90° to see how far the braking
 lights of the car in front are away :-)
 
 jan
 
 
 
 On 01/03/2011 21:35, Jim Pflugrath wrote:
 I will offer my view.
 
 I hate stereo glasses and hate stereo in general.
 
 One should be able to see 3D from the depth-cueing and by keeping the view
 in motion.  For fitting, I like to flip the view by 90 degrees.  I know I am
 going to move in displayX and displayY, but never in displayZ.  I then
 rotate the view around the vertical axis so thatn the old displayZ becomes
 displayX.
 
 Furthermore, I don't waste too much time fitting.  I know the software can
 fit the map better than me, so I let it do its job.  I only need to get the
 coordinates within the radius of convergence of the refinement program.  I
 also know that 9 times out of 10, the displayed electron density is probably
 suspect, so I believe in stereochemistry more than I believe in the map.
 
 The main trick is to realize that as a human being, you really are not that
 good at fitting the map or that it is unnecessary to waste your time since
 the software is really so much better than you

Re: [ccp4bb] while on the subject of stereo

2011-03-03 Thread Sergei Strelkov

Dear Dave,

Here come my five pence...
I personally found stereo graphics useful in two cases.

1. When you first introduce students to biomolecular
structure and/or biocrystallography. Showing stereo
certainly helps 'building up' the initial fascination,
which is very important of course. But since we do not
have a classroom stereo setup, I am just speaking
of seating a new/prospective (graduate) student
in front of a stereo workstation.

2. When one performs more difficult tasks while
doing research (although it was not your question).
This includes building difficult regions in poor/low resolution
maps as already mentioned, but maybe even more
importantly when trying to make sense of a difficult
MR case and finally when dealing with protein docking.

However:
1. In my experience, what at least the better students
do is to look at a structure using a simple program
like Swiss PDB Viewer or Rasmol and their 300 euro
laptop. No arguments can persuade them
to use the 3000 euro lab stereo setup -- because they
can manage to see what they want to see by just
rotating the molecule...

2. For both teaching purposes and publications,
I remain an adept of printed stereo pairs.
Get each of your students a 5 euro stereo viewer
and give them a handout full of stereo pairs
rather than mono images. The very important
this is that, on paper, one can make
notes and drawings. An active digestion
of the teaching material (rather than passive
starring at your screen) has been known to help
efficient learning since long ago...

I can summarize my view as follows:
for /most/ purposes, you should be fine
by using one of the two:
simple mono graphics to achieve
the 3D effect by rotation -- or printed
stereo pairs.

HTH
Sergei


Thanks for the comments, I do appreciate them.  I guess we went off in a
direction I wasn't thinking of - related to your personal like or
dislike of stereo.  What I am really looking for is an answer to a
simple question in that is stereo a nice thing from a pedagogy
standpoint for showing students complex biomolecules.

I am in a chemistry department - undergraduate only.  We focus on
3-dimensional shape and the importance of shape of chemical
function/reactivity/etc...  With small molecules (PF5, etc...), it's
easy to see how shape works by simply rotating the molecule.  The
molecules are small enough, the concept of 3D can be visualized easily
in these systems.  Furthermore, they can make a simple model using your
standard organic or inorganic model kit, no worries.

Now, bring in a huge protein, or a protein-protein complex.  The issue
of 3Dness becomes fuzzier.  It's not so easy to see which hydrogen will
get plucked off during a chemical reaction, even with careful zooming
and mouse manipulation.  So my question still is, how many of you feel
stereo is important from a pedagogy standpoint (not looking at maps,
just structures that are huge and complex).  Is it something that we
need to try to bring to the classroom, or is it just a cool toy like the
3D TV that hopefully is going nowhere and will soon fade out like the
viewmaster of old.  I know a large percentage of people cannot see
stereo (at least the way we present it), and so it isn't for everybody.
But, does it help, and if so, does it help when done in a huge classroom
or when put on an individual screen.  Has anybody tried to assess this
(there's a horrible word for you).

That's what I was wondering about.  Presenting the stereo is a different
issue (how is that done), but I think there are lots of avenues for that
depending on your particular situation.

Thanks again

Dave




Re: [ccp4bb] while on the subject of stereo

2011-03-03 Thread Ed Pozharski
On Wed, 2011-03-02 at 19:23 -0500, David Roberts wrote:
 What I am really looking for is an answer to a 
 simple question in that is stereo a nice thing from a pedagogy 
 standpoint for showing students complex biomolecules. 

Of course it is.  Exactly how much excitement it generates among the
millennials with their iThings is hard to gauge, but it definitely has
greater potential as a teaching tool than the formula for phased
translation function.

Cheers,

Ed. 

-- 
I'd jump in myself, if I weren't so good at whistling.
   Julian, King of Lemurs


Re: [ccp4bb] while on the subject of stereo

2011-03-02 Thread Pete Meyer
My take on things is that the helpfulness of stereo depends inversely on 
the resolution (and/or quality) of the data.  If I'm dealing with a 4-5 
Angstrom map, stereo is more or less required.  For high quality 2-3 
Angstrom data, not so much.


For teaching purposes, it's probably a good idea to use relatively good 
maps.  So stereo might not be necessary; other than to introduce people 
to it.


One thing I've noticed in training post-docs and grad students (in lab, 
not in a classroom) is that people who've played video games have an 
easier time adapting to graphics software than those who haven't.  So 
for new students it might be more helpful to tell them to go play a FPS, 
or (driving|flight) simulator for a few hours than keep reminding them 
to use the stereo glasses.


Pete

David Roberts wrote:

Hi again,

I'd like to ask a question about the pedagogy of stereo.  That is, using 
stereo with students in the classroom.


Do you all find that, after setting up these elaborate stereo devices, 
students really use the stereo or do they tend not to?


I am a huge fan of stereo - and frankly here we have quite a few options 
for doing stereo - from the active Nvidia systems that people have 
recently been discussing to passive zalmans.  I went from SGI systems 
and crystaleyes to linux systems using nuvision glasses, and finally 
have settled for Zalman stereo - as I think it is the best thing out 
there.  Zalman is passive - go to the movies and get a free pair of 
glasses (realD glasses work fine), and you don't have to have any video 
card requirements (I haven't tried using it with onboard stereo - I do 
have graphics cards, but I have a feeling onboard stereo wouldn't be bad).


When in a classroom - we project using glasses that work on an emitter 
based system (so it's active stereo - we are thinking of going passive 
in the classroom as well).  When we use stereo in a classroom, we find 
you take just as much time telling students they need to look forward as 
we do talking about active sites.  In some cases, the stereo may be 
distracting.  Many can't get it to work - and when they do I don't know 
how effective it is.


I teach a crystallography class, and for that I have a linux lab setup 
with 6 computers equipped with Zalman stereo (recent, it was active 
nuvision before).  Students have to fit a map and build a MIR structure 
(from scratch totally) using coot.  It's a great experience, but I find 
that I have to constantly get them to put on stereo glasses to get the 
best fit of their model in the map.  They tend to not do it, and so I'm 
trying to see if it's the type of stereo used (as I said, I had a few 
options, and this class actually has their range of devices) or if it's 
just that they can do it good enough without stereo.  They do prefer the 
LCD monitor over a CRT display (and that is a brightness thing I think - 
they are just crisper and newer).  When on the CRT's, they will use 
stereo (active), but when on the LCD displays stereo is not necessarily 
used (they don't seem to need it as much).


As I mentioned, I like stereo a lot, but really projecting on a nice 
bright lcd monitor also has it's advantages, and with the ease of moving 
things using the mouse (or whatever device you use), the overall need 
for stereo seems to be decreasing.  I don't know - I just wonder what 
peoples views are out there for the actual need for stereo.  It's 
incredibly cool - and I think is a very powerful way to show things - 
but I'm wondering if we focus too much on it because it's cool and not 
because it's pedagogically necessary.


Just wondering, no worries.  Thanks

Dave


Re: [ccp4bb] while on the subject of stereo

2011-03-02 Thread David Roberts
Thanks for the comments, I do appreciate them.  I guess we went off in a 
direction I wasn't thinking of - related to your personal like or 
dislike of stereo.  What I am really looking for is an answer to a 
simple question in that is stereo a nice thing from a pedagogy 
standpoint for showing students complex biomolecules.


I am in a chemistry department - undergraduate only.  We focus on 
3-dimensional shape and the importance of shape of chemical 
function/reactivity/etc...  With small molecules (PF5, etc...), it's 
easy to see how shape works by simply rotating the molecule.  The 
molecules are small enough, the concept of 3D can be visualized easily 
in these systems.  Furthermore, they can make a simple model using your 
standard organic or inorganic model kit, no worries.


Now, bring in a huge protein, or a protein-protein complex.  The issue 
of 3Dness becomes fuzzier.  It's not so easy to see which hydrogen will 
get plucked off during a chemical reaction, even with careful zooming 
and mouse manipulation.  So my question still is, how many of you feel 
stereo is important from a pedagogy standpoint (not looking at maps, 
just structures that are huge and complex).  Is it something that we 
need to try to bring to the classroom, or is it just a cool toy like the 
3D TV that hopefully is going nowhere and will soon fade out like the 
viewmaster of old.  I know a large percentage of people cannot see 
stereo (at least the way we present it), and so it isn't for everybody.  
But, does it help, and if so, does it help when done in a huge classroom 
or when put on an individual screen.  Has anybody tried to assess this 
(there's a horrible word for you).


That's what I was wondering about.  Presenting the stereo is a different 
issue (how is that done), but I think there are lots of avenues for that 
depending on your particular situation.


Thanks again

Dave


Re: [ccp4bb] while on the subject of stereo

2011-03-01 Thread Jim Pflugrath
I will offer my view.

I hate stereo glasses and hate stereo in general.  

One should be able to see 3D from the depth-cueing and by keeping the view
in motion.  For fitting, I like to flip the view by 90 degrees.  I know I am
going to move in displayX and displayY, but never in displayZ.  I then
rotate the view around the vertical axis so thatn the old displayZ becomes
displayX.

Furthermore, I don't waste too much time fitting.  I know the software can
fit the map better than me, so I let it do its job.  I only need to get the
coordinates within the radius of convergence of the refinement program.  I
also know that 9 times out of 10, the displayed electron density is probably
suspect, so I believe in stereochemistry more than I believe in the map.

The main trick is to realize that as a human being, you really are not that
good at fitting the map or that it is unnecessary to waste your time since
the software is really so much better than you.  Refinement is quick enough
that you can try various hypotheses as in:  If I move this here, then
refinement will do the trick and Well, that didn't work, so I will move
that over there and see if refinement will do the trick.

As for stereo figures, you should be able to convey what you want to say
from a good figure with depth-cueing, shadows, etc.  Don't ever use stereo
glasses in a public seminar.  Maybe my opinion will change with better
stereo technology.

OK, I know quite a lot of people will disagree with me. :)

Jim

-Original Message-
From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of David
Roberts
Sent: Tuesday, March 01, 2011 10:29 AM
To: CCP4BB@JISCMAIL.AC.UK
Subject: [ccp4bb] while on the subject of stereo

Hi again,

I'd like to ask a question about the pedagogy of stereo.  That is, using
stereo with students in the classroom.

Do you all find that, after setting up these elaborate stereo devices,
students really use the stereo or do they tend not to?

I am a huge fan of stereo - and frankly here we have quite a few options for
doing stereo - from the active Nvidia systems that people have recently been
discussing to passive zalmans. ...

As I mentioned, I like stereo a lot, but really projecting on a nice bright
lcd monitor also has it's advantages, and with the ease of moving things
using the mouse (or whatever device you use), the overall need for stereo
seems to be decreasing.  I don't know - I just wonder what peoples views are
out there for the actual need for stereo.  It's incredibly cool - and I
think is a very powerful way to show things - but I'm wondering if we focus
too much on it because it's cool and not because it's pedagogically
necessary.

Just wondering, no worries.  Thanks

Dave


Re: [ccp4bb] while on the subject of stereo

2011-03-01 Thread Jan Löwe
Ah! The question of to stereo or not to stereo! There has to be a 
scientific reason why this question is more popular than asking for what 
Linux distro is more fashionable this spring or why an Rmerge of 0.90 in 
the outermost shell is good for you and your structure.


I am offering my two (conflicting) theories (and apologies that both 
seem to imply some problem):


A) people who do use stereo have a problem with their brain because they 
cannot produce three dimensional vision from depth cues alone.


B) people who do not use stereo have a problem with their brain because 
they cannot see properly in three dimensions and rely on depth cues alone.


I personally prefer people with A) when I am their passenger in a car 
since they do not need to rotate by 90° to see how far the braking 
lights of the car in front are away :-)


jan



On 01/03/2011 21:35, Jim Pflugrath wrote:

I will offer my view.

I hate stereo glasses and hate stereo in general.

One should be able to see 3D from the depth-cueing and by keeping the view
in motion.  For fitting, I like to flip the view by 90 degrees.  I know I am
going to move in displayX and displayY, but never in displayZ.  I then
rotate the view around the vertical axis so thatn the old displayZ becomes
displayX.

Furthermore, I don't waste too much time fitting.  I know the software can
fit the map better than me, so I let it do its job.  I only need to get the
coordinates within the radius of convergence of the refinement program.  I
also know that 9 times out of 10, the displayed electron density is probably
suspect, so I believe in stereochemistry more than I believe in the map.

The main trick is to realize that as a human being, you really are not that
good at fitting the map or that it is unnecessary to waste your time since
the software is really so much better than you.  Refinement is quick enough
that you can try various hypotheses as in:  If I move this here, then
refinement will do the trick and Well, that didn't work, so I will move
that over there and see if refinement will do the trick.

As for stereo figures, you should be able to convey what you want to say
from a good figure with depth-cueing, shadows, etc.  Don't ever use stereo
glasses in a public seminar.  Maybe my opinion will change with better
stereo technology.

OK, I know quite a lot of people will disagree with me. :)

Jim

-Original Message-
From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of David
Roberts
Sent: Tuesday, March 01, 2011 10:29 AM
To: CCP4BB@JISCMAIL.AC.UK
Subject: [ccp4bb] while on the subject of stereo

Hi again,

I'd like to ask a question about the pedagogy of stereo.  That is, using
stereo with students in the classroom.

Do you all find that, after setting up these elaborate stereo devices,
students really use the stereo or do they tend not to?

I am a huge fan of stereo - and frankly here we have quite a few options for
doing stereo - from the active Nvidia systems that people have recently been
discussing to passive zalmans. ...

As I mentioned, I like stereo a lot, but really projecting on a nice bright
lcd monitor also has it's advantages, and with the ease of moving things
using the mouse (or whatever device you use), the overall need for stereo
seems to be decreasing.  I don't know - I just wonder what peoples views are
out there for the actual need for stereo.  It's incredibly cool - and I
think is a very powerful way to show things - but I'm wondering if we focus
too much on it because it's cool and not because it's pedagogically
necessary.

Just wondering, no worries.  Thanks

Dave


Re: [ccp4bb] while on the subject of stereo

2011-03-01 Thread Edward A. Berry

Jim Pflugrath wrote:


One should be able to see 3D from the depth-cueing and by keeping the view
in motion.



 Don't ever use stereo glasses in a public seminar.


putting the molecule in motion is a good way to let the audience see 3D.
I like to make a small animated gif (rocking gif) which rotates back
and forth through 3 or 5 pictures covering 5-10 degrees of rotaton about Y.

It seems recent versions of powerpoint have dropped support for
animated gif, so if I ever have to upgrade PP beyond office97 or 2000,
I will have to use movies, which I suspect will be significantly larger.

I heard somewhere that the reason chickens (which have eyes on
the opposite sides of their heads, giving binocular vision a
different meaning) bob their heads up and down is to get a 3D
perspective.  Definitely Jan Löwe's type B beings.

eab


Re: [ccp4bb] while on the subject of stereo

2011-03-01 Thread Jacob Keller
 I heard somewhere that the reason chickens (which have eyes on
 the opposite sides of their heads, giving binocular vision a
 different meaning) bob their heads up and down is to get a 3D
 perspective.

Check out egrets when they are fishing--definitely triangulating,
maybe refraction-artifact-cancelling.

JPK

***
Jacob Pearson Keller
Northwestern University
Medical Scientist Training Program
cel: 773.608.9185
email: j-kell...@northwestern.edu
***


Re: [ccp4bb] While on the subject of stereo

2008-05-14 Thread Warren DeLano
Hi David,
 
This has already been done with PyMOL.  There's a video at:
 
http://molviz.cs.toronto.edu/molviz/
 
and the code is downloadable.
 
The stereo effect isn't so great with both eyes open, but I do think there is 
potential for use of head or object tracking as a means of controlling rotation.
 
Cheers,
Warren



From: CCP4 bulletin board on behalf of David Roberts
Sent: Wed 5/14/2008 12:59 PM
To: CCP4BB@JISCMAIL.AC.UK
Subject: [ccp4bb] While on the subject of stereo



OK, so we weren't on this subject, and all of you are tired of me
asking.  However, the following link came to me and I wanted to see some
programmers opinions on this one.  The thing I'm wondering is, what
needs to be done on the programming end to make this something that we
could use in a classroom to show molecules in stereo.  It seems like it
would be fun, and I actually think it would work well, though I don't
know if it would work with more than one person looking at the screen at
a time (now that I really think about it, probably not - nevermind).  If
it only works with one person, can we use this for modeling?

Just curious

www.ted.com/index.php/talks/view/id/245

Dave