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@article{407715,
author = {Padrta, Petr and Sklenář, Vladimír},
article_location = {Dordrecht},
article_number = {4},
keywords = {computer graphics; interatomic distance; NMR; scalar coupling constant; software; torsion angle},
language = {eng},
issn = {0925-2738},
journal = {Journal of Biomolecular NMR},
title = {Program MULDER - A tool for extracting torsion angles from NMR data},
volume = {24},
year = {2002}
}
TY - JOUR
ID - 407715
AU - Padrta, Petr - Sklenář, Vladimír
PY - 2002
TI - Program MULDER - A tool for extracting torsion angles from NMR data
JF - Journal of Biomolecular NMR
VL - 24
IS - 4
SP - 339
EP - 339
PB - Kluwer/Escom
SN - 09252738
KW - computer graphics
KW - interatomic distance
KW - NMR
KW - scalar coupling constant
KW - software
KW - torsion angle
N2 - MULDER (Mostly UniversaL Dihedral angle ExtractoR) is a program for extraction of torsion angle information from NMR data. Currently, it can analyze two types of input data: The torsion angle data, where several 3J-coupling constants and/or interatomic distances are combined in order to reduce the torsion angle ambiguity arising from solving the isolated Karplus (or distance) equation, and the sugar pucker data, where the dynamics of five-membered sugar rings is evaluated by postprocessing the results calculated from 3J(HH) coupling constants by program PSEUROT. Program MULDER can be used either as an alternative to r-MD programs in situations where only specific structural features are studied, or as a preparatory tool in connection with full r-MD structure calculation for extraction of unambiguous torsion angle restraints.
ER -
PADRTA, Petr and Vladimír SKLENÁŘ. Program MULDER - A tool for extracting torsion angles from NMR data. \textit{Journal of Biomolecular NMR}. Dordrecht: Kluwer/Escom, 2002, vol.~24, No~4, p.~339-349. ISSN~0925-2738.
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