[gmx-users] how to analye a single structure (NMR or X-ray) by PCA?
zhaoxiitc2002 at yahoo.com.cn
Wed Mar 24 15:00:50 CET 2010
Dear sir :
I want to analye a collective motions of a single structure by PCA , for example, how to choose reference structure using g_covar; how to show its position in 2D-projection (conformational space)?
thank you very much!
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