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Antonio Frontera
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OPLS all‐atom force field for carbohydrates
W Damm, A Frontera, J Tirado–Rives, WL Jorgensen
Journal of computational chemistry 18 (16), 1955-1970, 1997
8861997
Anion-pi Interactions: do they exist?
D Quiñonero, C Garau, C Rotger, A Frontera, P Ballester, A Costa, ...
Angewandte Chemie-International Edition, 2002, vol. 41, num. 18, p. 3389-3392, 2002
8172002
Putting anion–π interactions into perspective
A Frontera, P Gamez, M Mascal, TJ Mooibroek, J Reedijk
Angewandte Chemie International Edition 50 (41), 9564-9583, 2011
6842011
Tetrel‐bonding interaction: rediscovered supramolecular force?
A Bauzá, TJ Mooibroek, A Frontera
Angewandte Chemie International Edition 52 (47), 12317-12321, 2013
6612013
The bright future of unconventional σ/π‐hole interactions
A Bauzá, TJ Mooibroek, A Frontera
ChemPhysChem 16 (12), 2496-2517, 2015
6102015
Definition of the chalcogen bond (IUPAC Recommendations 2019)
CB Aakeroy, DL Bryce, GR Desiraju, A Frontera, AC Legon, F Nicotra, ...
Pure and Applied Chemistry 91 (11), 1889-1892, 2019
3732019
Aerogen bonding interaction: a new supramolecular force?
A Bauzá, A Frontera
Angewandte Chemie International Edition 54 (25), 7340-7343, 2015
3312015
Not only hydrogen bonds: Other noncovalent interactions
I Alkorta, J Elguero, A Frontera
Crystals 10 (3), 180, 2020
3262020
Supramolecular self-assembly of M-IDA complexes involving lone-pair··· π interactions: crystal structures, hirshfeld surface analysis, and DFT calculations [H2IDA …
SK Seth, I Saha, C Estarellas, A Frontera, T Kar, S Mukhopadhyay
Crystal growth & design 11 (7), 3250-3265, 2011
3252011
Cooperativity in multiple unusual weak bonds
I Alkorta, F Blanco, PM Deya, J Elguero, C Estarellas, A Frontera, ...
Theoretical Chemistry Accounts 126, 1-14, 2010
2802010
On the reliability of pure and hybrid DFT methods for the evaluation of halogen, chalcogen, and pnicogen bonds involving anionic and neutral electron donors
A Bauza, I Alkorta, A Frontera, J Elguero
Journal of chemical theory and computation 9 (11), 5201-5210, 2013
2752013
Halogen bonding versus chalcogen and pnicogen bonding: a combined Cambridge structural database and theoretical study
A Bauzá, D Quinonero, PM Deya, A Frontera
CrystEngComm 15 (16), 3137-3144, 2013
2352013
A topological analysis of the electron density in anion–π interactions
C Garau, A Frontera, D Quiñonero, P Ballester, A Costa, PM Deyà
ChemPhysChem 4 (12), 1344-1348, 2003
2332003
Anion induced formation of supramolecular associations involving lone pair− π and anion− π interactions in Co (II) malonate complexes: experimental observations, Hirshfeld …
P Manna, SK Seth, A Das, J Hemming, R Prendergast, M Helliwell, ...
Inorganic Chemistry 51 (6), 3557-3571, 2012
2132012
Structure and binding energy of anion− π and cation− π complexes: a comparison of MP2, RI-MP2, DFT, and DF-DFT methods
D Quiñonero, C Garau, A Frontera, P Ballester, A Costa, PM Deyà
The journal of physical chemistry A 109 (20), 4632-4637, 2005
2092005
Cation− π versus anion− π interactions: energetic, charge transfer, and aromatic aspects
C Garau, A Frontera, D Quiñonero, P Ballester, A Costa, PM Deyà
The Journal of Physical Chemistry A 108 (43), 9423-9427, 2004
2092004
Cation–π and anion–π interactions
A Frontera, D Quinonero, PM Deya
Wiley Interdisciplinary Reviews: Computational Molecular Science 1 (3), 440-459, 2011
2062011
A thorough anion–π interaction study in biomolecules: on the importance of cooperativity effects
X Lucas, A Bauzá, A Frontera, D Quinonero
Chemical science 7 (2), 1038-1050, 2016
2042016
Tetrel bonding interactions
A Bauzá, TJ Mooibroek, A Frontera
The Chemical Record 16 (1), 473-487, 2016
2032016
Counterintuitive interaction of anions with benzene derivatives
D Quiñonero, C Garau, A Frontera, P Ballester, A Costa, PM Deya
Chemical physics letters 359 (5-6), 486-492, 2002
2022002
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