S3EPY: a Sparky extension for determination of small scalar couplings from spin-state-selective excitation NMR experiments.
S3EPY is a Python extension to the program Sparky written to facilitate the assessment of coupling constants from in-phase/antiphase and spin-state-selective excitation (S(3)E) experiments. It enables the routine use of small scalar couplings by automating the coupling evaluation procedure. S3EPY provides an integrated graphical user interface to programs which outputs graphs and the table of determined couplings.
Novák
Petr
P
National Centre for Biomolecular Research, Faculty of Science, Masaryk University, Kotlárská 2, 611 37, Brno, Czech Republic.
Zídek
Lukás
L
Motácková
Veronika
V
Padrta
Petr
P
Svenková
Alzbeta
A
Nuzillard
Jean-Marc
JM
Krásný
Libor
L
Sklenár
Vladimír
V
D001412:Bacillus subtilis / Q000201:enzymology; D012321:DNA-Directed RNA Polymerases / Q000737:chemistry; D019906:Nuclear Magnetic Resonance, Biomolecular / Q000379:methods*; D012984:Software; D014584:User-Computer Interface
D012321:DNA-Directed RNA Polymerases