
24 Feb
2013
24 Feb
'13
2:07 p.m.
Dear chimera users, I have been studying the association between a protein and an electrode by MD simulation. In particular I am interested in the relative orientation in respect to the surface. I only have the PM-IRRAS spectrum of the complex. I am wondering if someone knows a method or a software that simulate the PM-IRRAS spectrum or the infrared spectrum of a protein. Thank you in advance, Francesco
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francesco oteri