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Geronimo, Inacrist
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Online (40)
Mediatypes
Articles (Online) (26)
OpenAccess-fulltext (14)
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1
Computer-aided identification, synthesis, and biological ev..:
Munafò, Federico
;
Nigro, Michela
;
Brindani, Nicoletta
...
European Journal of Medicinal Chemistry. 248 (2023) - p. 115044 , 2023
Link:
https://doi.org/10.1016/..
?
2
On the Role of Molecular Conformation of the 8-Oxoguanine L..:
Geronimo, Inacrist
;
Vidossich, Pietro
;
De Vivo, Marco
Journal of Chemical Information and Modeling. 63 (2023) 5 - p. 1521-1528 , 2023
Link:
https://doi.org/10.1021/..
?
3
Alchemical Free-Energy Calculations of Watson–Crick and Hoo..:
Geronimo, Inacrist
;
De Vivo, Marco
Journal of Chemical Theory and Computation. 18 (2022) 11 - p. 6966-6973 , 2022
Link:
https://doi.org/10.1021/..
?
4
Computational investigations of polymerase enzymes: Structu..:
Geronimo, Inacrist
;
Vidossich, Pietro
;
Donati, Elisa
.
WIREs Computational Molecular Science. 11 (2021) 6 - p. , 2021
Link:
https://doi.org/10.1002/..
?
5
Cover Image, Volume 11, Issue 6:
Geronimo, Inacrist
;
Vidossich, Pietro
;
Donati, Elisa
.
WIREs Computational Molecular Science. 11 (2021) 6 - p. , 2021
Link:
https://doi.org/10.1002/..
?
6
Local Structural Dynamics at the Metal-Centered Catalytic S..:
Geronimo, Inacrist
;
Vidossich, Pietro
;
De Vivo, Marco
ACS Catalysis. 11 (2021) 22 - p. 14110-14121 , 2021
Link:
https://doi.org/10.1021/..
?
7
Kinetic and molecular dynamics study of inhibition and tran..:
Geronimo, Inacrist
;
Ntarima, Patricia
;
Piens, Kathleen
...
Journal of Biological Chemistry. 294 (2019) 9 - p. 3169-3180 , 2019
Link:
https://doi.org/10.1074/..
?
8
The role of catalytic residue pKa on the hydrolysis/transgl..:
Geronimo, Inacrist
;
Payne, Christina M.
;
Sandgren, Mats
Organic & Biomolecular Chemistry. 16 (2018) 2 - p. 316-324 , 2018
Link:
https://doi.org/10.1039/..
?
9
Hydrolysis and Transglycosylation Transition States of Glyc..:
Geronimo, Inacrist
;
Payne, Christina M.
;
Sandgren, Mats
The Journal of Physical Chemistry B. 122 (2018) 41 - p. 9452-9459 , 2018
Link:
https://doi.org/10.1021/..
?
10
Desulfination by 2′-hydroxybiphenyl-2-sulfinate desulfinase..:
Geronimo, Inacrist
;
Nigam, Shawn R.
;
Payne, Christina M.
Chemical Science. 8 (2017) 7 - p. 5078-5086 , 2017
Link:
https://doi.org/10.1039/..
?
11
Analyzing sites of OH radical attack (ring vs. side chain) ..:
Zhang, Ning
;
Geronimo, Inacrist
;
Paneth, Piotr
...
Science of The Total Environment. 542 (2016) - p. 484-494 , 2016
Link:
https://doi.org/10.1016/..
?
12
Effect of Mutation and Substrate Binding on the Stability o..:
Geronimo, Inacrist
;
Denning, Catherine A.
;
Rogers, W. Eric
...
Biochemistry. 55 (2016) 25 - p. 3594-3606 , 2016
Link:
https://doi.org/10.1021/..
?
13
Cytochrome P450-catalyzed dealkylation of atrazine byRhodoc..:
Meyer, Armin H.
;
Dybala-Defratyka, Agnieszka
;
Alaimo, Peter J.
...
Dalton Trans.. 43 (2014) 32 - p. 12175-12186 , 2014
Link:
https://doi.org/10.1039/..
?
14
A DFT and ONIOM study of C–H hydroxylation catalyzed by nit..:
Geronimo, Inacrist
;
Paneth, Piotr
Phys. Chem. Chem. Phys.. 16 (2014) 27 - p. 13889-13899 , 2014
Link:
https://doi.org/10.1039/..
?
15
Molecular Dynamics Simulation of Nitrobenzene Dioxygenase U..:
Pabis, Anna
;
Geronimo, Inacrist
;
York, Darrin M.
.
Journal of Chemical Theory and Computation. 10 (2014) 6 - p. 2246-2254 , 2014
Link:
https://doi.org/10.1021/..
1-15