Try the Materials Informatics Toolkit, which is designed to easily handle SMILES data. This and other helpful add-ins are available in the JMP® Marketplace
Are you able to script JMP? If so, I can provide a script that I wrote to calculate many such diagnostic values for a regression. You might be able to extract or modify this code to suit your purpose.
Are you able to script JMP? If so, I can provide a script that I wrote to calculate many such diagnostic values for a regression. You might be able to extract or modify this code to suit your purpose.
Hi Mark - thanks for your reply! I am a SAS programmer but have not scripted in JMP. I am using JMP for data mining class (shifted from SAS) because of its ease of use for undergrad students. Can you please send me the script and I will figure out how to edit it for my purposes? I appreciate it... also I am glad to know that I am not missing the DFEBETAs - that they are just not provided through the JMP interface. Thanks again! Joni
