SHIFTX2: significantly improved protein chemical shift prediction
نویسندگان
چکیده
منابع مشابه
SHIFTX2: significantly improved protein chemical shift prediction
A new computer program, called SHIFTX2, is described which is capable of rapidly and accurately calculating diamagnetic (1)H, (13)C and (15)N chemical shifts from protein coordinate data. Compared to its predecessor (SHIFTX) and to other existing protein chemical shift prediction programs, SHIFTX2 is substantially more accurate (up to 26% better by correlation coefficient with an RMS error that...
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ژورنال
عنوان ژورنال: Journal of Biomolecular NMR
سال: 2011
ISSN: 0925-2738,1573-5001
DOI: 10.1007/s10858-011-9478-4