Aurelien de la Lande
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Explore the profile of Aurelien de la Lande including associated specialties, affiliations and a list of published articles.
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64
Citations
290
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Recent Articles
1.
Deviers J, Cailliez F, de la Lande A, Kattnig D
Comput Struct Biotechnol J
. 2024 Jan;
26:11-21.
PMID: 38204818
Flavin-binding cryptochromes are blue-light sensitive photoreceptors that have been implicated with magnetoreception in some species. The photocycle involves an intra-protein photo-reduction of the flavin cofactor, generating a magnetosensitive radical pair,...
2.
Tandiana R, Omar K, Luppi E, Cailliez F, Van-Oanh N, Clavaguera C, et al.
J Chem Theory Comput
. 2023 Oct;
19(21):7740-7752.
PMID: 37874960
The electronic stopping power is an observable property that quantifies the ability of swift ions to penetrate matter to transfer energy to the electron cloud. The recent literature has proven...
3.
Tolu D, Guillaumont D, de la Lande A
J Phys Chem A
. 2023 Aug;
127(34):7045-7057.
PMID: 37606197
The PUREX solvent extraction process, widely used for recovering uranium and plutonium from spent nuclear fuel, utilizes an organic solvent composed of tributyl phosphate (TBP). The emission of ionizing particles...
4.
rezac J, de la Lande A
Chemphyschem
. 2023 Jul;
24(18):e202300329.
PMID: 37405855
Charge transfer is one of the mechanisms involved in non-covalent interactions. In molecular dimers, its contribution to pairwise interaction energies has been studied extensively using a variety of interaction energy...
5.
Parise A, Ciardullo G, Prejano M, de la Lande A, Marino T
J Chem Inf Model
. 2022 Oct;
62(20):4916-4927.
PMID: 36219674
The novel coronavirus SARS-CoV-2 is the causative agent of the COVID-19 outbreak that is affecting the entire planet. As the pandemic is still spreading worldwide, with multiple mutations of the...
6.
Deviers J, Cailliez F, Gutierrez B, Kattnig D, de la Lande A
Phys Chem Chem Phys
. 2022 Jul;
24(27):16784-16798.
PMID: 35775941
The radicals derived from flavin adenine dinucleotide (FAD) are a corner stone of recent hypotheses about magnetoreception, including the compass of migratory songbirds. These models attribute a magnetic sense to...
7.
Korsaye F, de la Lande A, Ciofini I
J Comput Chem
. 2022 Jun;
43(22):1464-1473.
PMID: 35766295
Considering as test case a family of organic rod like push-pull molecules, we derived and applied density based index enabling the description and diagnostic of the electronic density evolution in...
8.
Fateminasab F, de la Lande A, Omidyan R
RSC Adv
. 2022 Apr;
12(8):4703-4713.
PMID: 35425484
The effect of distal histidine on ligation of NO to ferrous and ferric-heme, has been investigated with the high-level density functional theoretical (DFT) method. It has been predicted that the...
9.
Deviers J, Cailliez F, de la Lande A, Kattnig D
J Chem Phys
. 2022 Jan;
156(2):025101.
PMID: 35032990
The avian compass and many other of nature's magnetoreceptive traits are widely ascribed to the protein cryptochrome. There, magnetosensitivity is thought to emerge as the spin dynamics of radicals in...
10.
de la Lande A, Denisov S, Mostafavi M
Phys Chem Chem Phys
. 2021 Sep;
23(37):21148-21162.
PMID: 34528029
The early mechanisms by which ionizing rays damage biological structures by so-called direct effects are largely elusive. In a recent picosecond pulse radiolysis study of concentrated uridine monophosphate solutions [J....