Hello Taylor-- > > Thank you so much for your previous suggestions regarding an issue I was > having > before, incorporating RDCs and linking them to my PCS tensors.( http:// > comments.gmane.org/gmane.science.biology.xplor-nih.general/1956 ). Both > suggestions you provided worked really well for one metal ion. However, I run > into problems when I try to incorporate RDCs for multiple metal ions. While I > was able to successfully incorporate PCS for multiple lanthanides, no matter > what > I do it will only take the RDCs for the last metal ion that I specify. Is > there > a way to incorporate RDCs for more than one metal ion and still be able to > link > the tensor to the PCS tensor for the corresponding metal ion?
Certainly. You need to specify the oTensor argument of create_RDCPot as oTensor=pcs.oTensor, where pcs is the appropriate pcs term. Please let me know if you have further questions about this - you might send a script if you still have problems. best regards-- Charles _______________________________________________ Xplor-nih mailing list [email protected] https://dcb.cit.nih.gov/mailman/listinfo/xplor-nih
