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Volumn 530, Issue 3, 2000, Pages 291-300
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Suitability of different levels of theory for modelling of hydroxamic acids
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Author keywords
Acetohydroxamic acid; Anharmonic vibrations; B3LYP, AM1, MP2 comparison; Thermodynamic properties
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Indexed keywords
HYDROXAMIC ACID;
ARTICLE;
CALCULATION;
HYDROGEN BOND;
IRON CHELATION;
MEMORY;
PROTEIN CONFORMATION;
PROTEIN STRUCTURE;
REPRODUCIBILITY;
STATISTICAL ANALYSIS;
THEORY;
THERMODYNAMICS;
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EID: 0034597356
PISSN: 01661280
EISSN: None
Source Type: Journal
DOI: 10.1016/S0166-1280(00)00342-0 Document Type: Article |
Times cited : (16)
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References (37)
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