引用次数
引用: 3,615
H-指数: 32
I10-指数 : 101
出版物: 170
One-pot synthesis of 4-aminated pyrrolo[2,3-d]pyrimidines from alkynylpyrimidines under metal-catalyst-free conditions
Vanessa Prieur , Nina Heindler , Jaime Rubio-Martínez , Gérald Guillaumet
Tetrahedron 71 ( 8) 1207 -1214
10
2015
Atomic level rendering of DNA-drug encounter.
Maria F. Lucas , Israel Cabeza de Vaca , Ryoji Takahashi , Jaime Rubio-Martínez
Biophysical Journal 106 ( 2) 421 -429
10
2014
Exploring potential energy surfaces with gentlest ascent dynamics in combination with the shrinking dimer method and Newtonian dynamics
Guillem Albareda , Josep Maria Bofill , Ibério de P. R. Moreira , Wolfgang Quapp
Theoretical Chemistry Accounts 137 ( 6) 1 -10
4
2018
Structural Analysis of the Inhibition of Cdk4 and Cdk6 by p16INK4athrough Molecular Dynamics Simulations
Óscar Villacañas , Juan J. Pérez , Jaime Rubio-Martínez
Journal of Biomolecular Structure and Dynamics 20 ( 3) 347 -358
20
2002
Binding of the anticancer drug BI-2536 to human serum albumin. A spectroscopic and theoretical study
Jesús Fernández-Sainz , Pedro J. Pacheco-Liñán , José M. Granadino-Roldán , Iván Bravo
Journal of Photochemistry and Photobiology B-biology 172 77 -87
5
2017
On the Use of the Discrete Constant pH Molecular Dynamics to Describe the Conformational Space of Peptides.
Cristian Privat , Sergio Madurga , Francesc Mas , Jaime Rubio-Martínez
Polymers 13 ( 1) 99
2020
Microwave‐Assisted Synthesis of Substituted Pyrrolo[2,3‐d]pyrimidines
Vanessa Prieur , Jaime Rubio-Martínez , Mercè Font-Bardia , Gérald Guillaumet
European Journal of Organic Chemistry 2014 ( 7) 1514 -1524
17
2014
Substituted tetrahydroisoquinolines: synthesis, characterization, antitumor activity and other biological properties.
A. Sergi Capilla , Richard Soucek , Laura Grau , Manel Romero
European Journal of Medicinal Chemistry 145 51 -63
7
2018
Discovery of diverse natural products as inhibitors of SARS-CoV-2 Mpro protease through virtual screening
Jaime Rubio-Martínez , Ana Jiménez-Alesanco , Laura Ceballos-Laita , David Ortega-Alarcón
Journal of chemical information and modeling 61 ( 12) 6094 -6106
10
2021
A hotspot for posttranslational modifications on the androgen receptor dimer interface drives pathology and anti-androgen resistance
Andrea Alegre-Martí , Alba Jiménez-Panizo , Adrián Martínez-Tébar , Coralie Poulard
Science Advances 9 ( 11) eade2175 -eade2175
8
2023
Supplementary Materials for A hotspot for posttranslational modifications on the androgen receptor dimer interface drives pathology and resistance to antiandrogens
Andrea Alegre-Martí , Alba Jiménez-Panizo , Adrián Martínez-Tébar , Coralie Poulard
American Association for the Advancement of Science
2023
The Discovery of inhibitors of the SARS-CoV-2 S protein through computational drug repurposing
Ana Isabel Avilés-Alía , Joao Zulaica , Juan J Perez , Jaime Rubio-Martínez
Computers in biology and medicine 171 108163 -108163
2
2024
Supporting information Shedding Light on Dark Chemical Matter: The Discovery of a SARS-CoV-2 Mpro Main Protease Inhibitor through Intensive Virtual Screening and In Vitro Evaluation
María Nuria Peralta-Moreno , Yago Mena , David Ortega-Alarcón , Ana Jiménez-Alesanco
Multidisciplinary Digital Publishing Institute
2024
Discovery of inhibitors of the SARS-CoV-2 S-protein through drug computational drug repurposing
Jaime Rubio-Martínez , Manuel Montejo , Juan J Pérez-González , Jose M Granadino-Roldan
2022
Shedding light on the binding mechanism of kinase inhibitors BI-2536, Volasetib and Ro-3280 with their pharmacological target PLK1
Jesús Fernández-Sainz , Pedro J Pacheco-Liñán , José M Granadino-Roldán , Iván Bravo
Journal of Photochemistry and Photobiology B: Biology 232 112477 -112477
6
2022
α4-α5 Helices on Surface of KRAS Can Accommodate Small Compounds That Increase KRAS Signaling While Inducing CRC Cell Death
Baraa Abuasaker , Eduardo Garrido , Marta Vilaplana , Jesús Daniel Gómez-Zepeda
International Journal of Molecular Sciences 24 ( 1) 748 -748
2
2023
Induction of the inflammasome by the SARS-CoV-2 accessory protein ORF9b, abrogated by small-molecule ORF9b homodimerization inhibitors
Erika Zodda , Mònica Pons , Natàlia DeMoya-Valenzuela , Cristina Calvo-González
bioRxiv 2024.05. 31.596900 -2024.05. 31.596900
2024
Design of Peptidomimetics
Juan J Perez , Francesc J Corcho , Jaime Rubio‐Martinez
Burger's Medicinal Chemistry and Drug Discovery 205 -248
3
2003
The analysis of the chemisorption bond from uncorrelated and correlated cluster model wave functions
J. M. Ricart , A. Clotet , F. Illas , J. Rubio
Journal of Chemical Physics 100 ( 3) 1988 -1994
26
1994
Bonding geometry and mechanism of NO adsorbed on Cu2O(111): NO activation by Cu+ cations
M. Fernández‐García , J. C. Conesa , P. S. Bagus , J. Rubio
Journal of Chemical Physics 101 ( 11) 10134 -10139
27
1994