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1989
Luque, FJ
,
Illas F
,
Pouplana R
. 1989.
Structure-activity relationships of H2-receptor histamine antagonists based on quantum chemical methods
.
Progress in clinical and biological research. 291:373-376.
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2005
Perez, A
,
Sponer J
,
Jurecka P
,
Hobza P
,
Luque FJ
,
Orozco M
. 2005.
Are the hydrogen bonds of RNA (AU) stronger than those of DNA (AT)? A quantum mechanics study
Chemistry (Weinheim an der Bergstrasse, Germany). 11(17):5062-5066.
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2009
Noy, A
,
Soteras I
,
Luque FJ
,
Orozco M
. 2009.
The impact of monovalent ion force field model in nucleic acids simulations
.
Physical chemistry chemical physics : PCCP. 11(45):10596-10607.
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2010
Bikiel, DE
,
Forti F
,
Boechi L
,
Nardini M
,
Luque FJ
,
Marti MA
,
Estrin DA
. 2010.
Role of heme distortion on oxygen affinity in heme proteins: the protoglobin case
.
The journal of physical chemistry.B. 114(25):8536-8543.
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Rayo, J
,
Munoz L
,
Rosell G
,
Hammock BD
,
Guerrero A
,
Luque FJ
,
Pouplana R
. 2010.
Reactivity versus steric effects in fluorinated ketones as esterase inhibitors: a quantum mechanical and molecular dynamics study
.
Journal of molecular modeling. 16(11):1753-1764.
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2011
Arroniz, C
,
Escolano C
,
Luque FJ
,
Bosch J
,
Amat M
. 2011.
First asymmetric cascade reaction catalysed by chiral primary aminoalcohols
.
Organic & biomolecular chemistry. 9(14):5079-5085.
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