Macros & Scripts to Accompanying ACD/Labs Software
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Macros & Scripts for ACD/Labs Software and Solutions

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Available Macros and Scripts

Type Technique Description Version Date Download
Script NMR Export to NMReDATA format. This new data format associates a chemical structure to the data extracted from NMR spectra (i.e. chemical shift values, signal integrals, intensities, multiplicities, scalar coupling constants, 2D correlations etc.). The goal of the NMReDATA initiative is to improve the quality of the NMR data available to the community. For more information about the applications of this file format, please click here. 2018.01 2018-09-26 Login

Version 12 and prior

Type Technique Description Version Date Download
Macro 1D NMR Integrate spectrum based on integral information from a reference spectrum, export the table of integrals and load the table in Excel. Test ESP files are also included. Note this is set to work for Microsoft Office 11 but can be modified if need be. 12.01 2010-04-09 Login
Macro 1D NMR Calculate the w/w% and set it to a user data field. Test ESP file and Quanalyst QPR are included. 12.01 2010-04-09 Login
Script Any Check the registry for a specific integer 12.01 2009-04-21 Login
Script Any Display a message box viewing all the atoms in a structure 12.01 2009-04-20 Login
Macro 1D NMR The macro file will search a Varian procpar file for the parameters sampwt and iswt (short for sample weight and internal standard weight). Note both files must be stored in the same folder. 12.01 2009-04-10 Login
Macro 1D NMR Perform different processing depending on the nucleus 12.01 2009-04-09 Login
Macro 1D NMR Peak fit and integrate a specific region 12.01 2009-04-08 Login
Macro 1D NMR Set variable file names to User data 12.01 2009-04-06 Login
Macro 1D NMR ZF, FT, Phase, PP, calculate S/N ratio 12.01 2009-04-05 Login
Macro Chrom Apply baseline, label solvent front, peak pick, integrate 12.01 2009-04-04 Login
Macro Curve Transform TGA data from weight to weight percentage and change the axes names 11.02 2008-12-01 Login
Macro 1D NMR Extract specific decimal place from a string 11.03 2008-10-29 Login
Macro 1D NMR ZF, FT an FID depending on the nucleus 11.03 2008-08-07 Login
Macro 2D NMR ZF, FT a 2D NMR dataset 11.03 2008-08-07 Login