AMBER Archive (2009)

Subject: [AMBER] Low frequency Raman spectra

From: babak minoofar (babak_minoofar_at_yahoo.com)
Date: Sat Nov 07 2009 - 06:53:37 CST

Dear AMBERS users,  I would like to calculate low frequency Raman spectra of organic solvent such as Formamide for this I have to do Fourier transformation of velocity correlationsof solvent molecules in order to get comparable data with low frequency Raman spectra. Can anybody help me with this task? Is anybody is using any script which can read AMBER trajectory and to do such calculationsBest regards Babak

      
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