[ccp4bb] Postdoctoral position, C2D2, University of York

2013-01-30 Thread A. Radu Aricescu
An exciting junior postdoc opportunity, ideal for the structure-educated biochemist looking to brush-up their maths skills (or finally put them to some good use :-)): Mathematical modelling of bi-­directional synaptic signalling Details at:

Re: [ccp4bb] RMSD Citation

2013-01-30 Thread Robbie Joosten
Note that we discuss rmsZ values in the paper, not rmsd. This is done on purpose; rmsd values do not take the standard deviation of bond lengths into account. This makes it needlessly difficult to compare values. Consider reporting rmsZ instead of rmsd. Cheers, Robbie Sent from my Windows

[ccp4bb] 2013 workshop on Neutron Scattering Applications in Structural Biology

2013-01-30 Thread Meilleur, Flora
Fourth Workshop on Neutron Scattering Applications in Structural Biology Oak Ridge, TN. June 24 - June 28, 2013 Application deadline: April 22, 2013 The workshop on Neutron Scattering Applications in Structural Biology aims at enabling structural biologist to fully exploit the latest

Re: [ccp4bb] RMSD Citation

2013-01-30 Thread Edward A. Berry
Maybe a silly question, but - Is this standard deviation of bond lengths that of each bond type in the Eng and Huber paper, or the standard deviations in the structure being validated? Robbie Joosten wrote: Note that we discuss rmsZ values in the paper, not rmsd. This is done on purpose; rmsd

Re: [ccp4bb] RMSD Citation

2013-01-30 Thread Ian Tickle
Hi Edward It's the E H value, i.e. the SU of the restraint, not that of the bond lengths angles which in most cases is not calculated (you need to form the full Hessian matrix to do it). The RMS Z-score doesn't behave as you might naively expect since you're actually comparing apples pears,