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nmrpipe · Information on use and features of NMRPipe, the system for multi-dimensional NMR spectral processing and analysis.
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Messages 575 - 605 of 2007   Oldest  |  < Older  |  Newer >  |  Newest
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575
When I use the showhdr program, I find a different OBS frequency is returned to that which I have provided in the original conversion script. Does anyone know:...
dark_isnewcdt
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Mar 5, 2004
11:48 am
576
Greetings ... This is an unusual report, because once the observe frequencies in MHZ are recorded during conversion (via -xOBS -yOBS ...) they are generally...
Frank Delaglio
bigfdelaglio
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Mar 5, 2004
5:52 pm
577
En... seems Charlie's 1st question not unanswered and that's also the a question has been lingering in my mind for a long time. So far to my knowledge, vnmr,...
Yufeng
crystalatom
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Mar 5, 2004
8:05 pm
578
Charlie, I'm not sure about the two OBS numbers, but the value it should have is the absolute frequency of 0.0 ppm. Frank told me some time ago that this...
Duncan M Smith
duncan@...
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Mar 5, 2004
11:16 pm
579
Hi, I would like to analyze some IPAP spectra with nlinLS, as I assume that should give me a better peak position than using the automatic peakpick functions...
Tara Sprules
tarasprules
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Mar 18, 2004
2:57 pm
580
Having used both Felix and nmrpipe, I have seen that Felix has several baseline correction/flattening options that aren't available in the core program of...
nmr_charlie
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Mar 18, 2004
2:58 pm
581
Many Greetings, Ok, good questions ... First, all note that there is a rather nice script "autoFit.tcl" which helps to automate the use of "nlinLS", everyone...
Frank Delaglio
bigfdelaglio
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Mar 22, 2004
7:41 pm
582
Hello, I have quite a number of datasets taken on a Bruker AM400 which I need to be able to process with nmrPipe. The files were all transferred from the...
Laurel O. Sillerud
laurel357
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Mar 23, 2004
11:43 pm
583
Hi All, The mysterious and often not-too-bad "POLY -auto" is described in the appendix of the publication describing NMRPipe. The excerpt is below. There is...
Frank Delaglio
bigfdelaglio
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Mar 23, 2004
11:44 pm
584
Hello, I am trying to setup a 3D acquisition on spinsight with a varian infinity console and was wondering what was the best way to do this to facilitate...
Robert Havlin
bobhavlin
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Mar 23, 2004
11:50 pm
585
Does TALOS rely on having all N,Ha,Ca,Cb and C shifts for a given residue to make a prediction? If I only have 4/5 or 3/5 of the necessary shifts and TALOS...
b0son
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Mar 25, 2004
9:24 am
586
Hi everybody, I am processing a HCACO type experiment. In which when i processed xz plane(H,CA),the spectra more or less looks like a mirror image about the CA...
sivachemist
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Mar 25, 2004
1:32 pm
587
Hi everybody, I am processing a HCACO type experiment. In which when i processed xz plane(H,CA),the spectra more or less looks like a mirror image about the CA...
sivachemist
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Mar 25, 2004
1:35 pm
588
Hi All, The reliability of TALOS has not been studied when just a subset of the 5 usual shifts are used. Interested and ambitious users can take existing...
Frank Delaglio
bigfdelaglio
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Mar 25, 2004
1:44 pm
589
I've got examples for processing scripts in our NMRPipe Library. http://www.nanuc.ca/downloads/downloads.php Then click on NANUC_NMRPipe_Library. I think...
Ryan McKay
ryan_nanuc
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Mar 25, 2004
5:38 pm
590
Check your quadrature mode in the conversion file (fid.com). Cheers Siddhartha ... -- Siddhartha P. Sarma Assistant Professor Molecular Biophysics Unit Indian...
Siddhartha Sarma
sidd@...
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Mar 25, 2004
6:10 pm
591
Hi, there. I try to process a Avance Version 3D-15N-TOCSY spectrum with nmrpipe, the pulse program is : mleviietf3gp3d. The xy(HSQC) plane is OK, but the xz ...
ju zhao
zhaoju2k4
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Mar 28, 2004
12:01 pm
593
Yes. You can also check the pulse program....
zhaoju2k4
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Mar 28, 2004
10:47 pm
594
Hi ju zhao, Please see the attached two script to convert and transform. They work on my pc at least. But there is a 180dgr phase difference on z dimension and...
Yufeng
crystalatom
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Mar 29, 2004
3:09 pm
595
YuFeng, Thanks . It works. The FT process of z dimension should use ... or ... not ... Have a good day. Ju ... === message truncated === ...
ju zhao
zhaoju2k4
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Mar 30, 2004
12:45 am
596
Did you try -neg flag during FT of mirro-image looking plane? VG From: "zhaoju2k4" <zhaoju2k4@...> Reply-To: nmrpipe@yahoogroups.com To:...
Vitaliy Gorbatyuk
vitaliy_gor@...
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Mar 30, 2004
9:49 pm
597
Well, this time it's me ... I used BioPack on Vnmr6.1C for a gNhsqcnoesyNhsqc experiments and acquired a 3D H-N-N spectra. But the xy or xz planes I processed...
Yufeng
crystalatom
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Mar 31, 2004
9:05 pm
598
Try y= states-tppi and z=rance/kay. it should work. cheers Siddhartha ... -- Siddhartha P. Sarma Assistant Professor Molecular Biophysics Unit Indian...
Siddhartha Sarma
sidd@...
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Apr 1, 2004
11:24 am
599
It is a problem of nmrPipe. It seems nmrPipe can not transform properly an experiment collected with sensitivity enhanced mode in two dimesions, i.e....
Vitaliy Gorbatyuk
vitaliy_gor@...
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Apr 1, 2004
10:12 pm
600
Hi All ... Yes, it's true that the conversion software can accept either "-yMODE Rance-Kay" or "-zMODE Rance-Kay" but not both together. Why? Because there is...
Frank Delaglio
bigfdelaglio
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Apr 1, 2004
10:26 pm
601
Thanks Frank & Vitaliy, I tried but the result seems to be the same. If you have time, could you please have a look at ...
Yufeng
crystalatom
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Apr 2, 2004
4:21 am
602
Yufeng, I think one of the problems you are having is that you ran your array as phase,phase2 rather than the more traditional phase2,phase. I also believe...
Mark Maciejewski
markm@...
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Apr 2, 2004
3:02 pm
603
Hey Mark, good contribution, thanks. Now, about "folding" and phase distortion. here are some comments: Cheerful Regards, big fd 1. FT -alt: is not uncommon in...
Frank Delaglio
bigfdelaglio
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Apr 2, 2004
7:13 pm
604
Hi,all, I want to install the BSD lpr print spooling system into my SGI work station (IRIX 6.5). I found the ftp site (ftp.sgi.com), but it seems that I need...
Yao, Huili
huiliyao
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Apr 4, 2004
3:17 am
605
Hi, After processing my 3D data with nmrPipe , I tried to analysis it with nmrView. I found that the chemical shift of the direct dimension in nmrView was...
ju zhao
zhaoju2k4
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Apr 6, 2004
10:31 am
Messages 575 - 605 of 2007   Oldest  |  < Older  |  Newer >  |  Newest
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