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Density functional theory
3
Hydrogen Bonding
3
article
3
density functional theory
geometry
hydrogen bond
3
oxygen
3
priority journal
Binding Sites
2
Heme
2
Humans
2
enzyme active site
2
hemoglobin
2
quantum mechanics
2
unclassified drug
2
6 o benzyl 2 deoxy 2 dimethylmaleimido alpha dextro allopyranoside
1
Allosamine
1
Amino Acid Substitution
1
Animals
1
Annelida
1
Aplysia
1
Armoracia rusticana
1
Bond distance
1
Carbohydrates
1
Carbonyl oxygen
1
Cerebratulus lacteus
1
Complex carbohydrates
1
Complexation
1
Computer simulation
1
Conformation
1
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1
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2JOUR
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3