From owner-chemistry@ccl.net Tue Mar 13 11:54:01 2012
From: "Laidig, Bill laidig.wd__pg.com" <owner-chemistry=server.ccl.net>
To: CCL
Subject: CCL: PCA using JMP from Amber .dat files
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X-Original-From: "Laidig, Bill" <laidig.wd%pg.com>
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Date: Tue, 13 Mar 2012 12:23:28 +0000
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Sent to CCL by: "Laidig, Bill" [laidig.wd]![pg.com]
I would read them into Excel, add header lines and then copy from Excel to JMP (this is typically how I get data into JMP).  Bill

-----Original Message-----
> From: owner-chemistry+laidig.wd==pg.com~!~ccl.net [mailto:owner-chemistry+laidig.wd==pg.com~!~ccl.net] On Behalf Of Kira A Armacost kza0004#%#auburn.edu
Sent: Monday, March 12, 2012 3:33 PM
To: Laidig, Bill
Subject: CCL: PCA using JMP from Amber .dat files


Sent to CCL by: "Kira A Armacost" [kza0004=auburn.edu] I'm trying to perform PCA using ptraj in Amber Tools from Amber 11. I've been able to get a .dat file with the eigenvectors and eigenvalues. I am wondering if these .dat files can be uploaded into JMP for further use with PCA? I'm able to upload them, but am running into an error with jmp because there is no headline for each column from the .dat file.
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