My software notes

May 26, 2006

spin dynamics

Filed under: book_list — kpwu @ 5:18 am

0471489220.jpg (more…)


May 19, 2006

sequence dependent random coil corrections

Filed under: softwares and scripts — kpwu @ 9:23 pm

GOAL: make a script that takes sequence as an input and returns a sequence-dependent corrections of random coil chemical shifts of CA, CO, HN, N and HA.


  1. Sequence-depent Correction of Random Coil NMR Chemical Shifts (JACS, 2001, 123, 2970-2978)
  2. Random coil chemical shifts in acidic 8M urea:Implementation of random coil shift data in NMRView (JBNMR, 2000, 18, 43-48)

Author Kuen-Phon Wu, Dept Chem, Rutgers University May 19th, 2006

Downloadable place at Ubuntu One (update 2011, 08-12)

snapshot of results of all HN,HA,CA,CB,CO and N

seq dept corrected random coil shifts


Blog at