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I am unable to get any signature peaks for the proteins like the amide band near 1500-1600 cm-1. I place a drop of the protein in buffer on the silica substrate and expose it to the laser. However...
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generated ligand-receptor complex from autodock. Generated a psf file for ligand and receptor seperately and also as a complex. When I load these files into NAMD and run it, the program crashes.
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