Nonenzymatic Reactions above Phospholipid Surfaces of Biological Membranes: Reactivity of Phospholipids and Their Oxidation Derivatives

por Solís-Calero, Christian, Ortega-Castro, Joaquín, Frau, Juan, Muñoz, Francisco
Publicado 2015

Conceptual DFT-Based Computational Peptidology, Pharmacokinetics Study and ADMET Report of the Veraguamides A–G Family of Marine Natural Drugs

por Flores-Holguín, Norma, Ortega-Castro, Joaquín, Frau, Juan, Glossman-Mitnik, Daniel
Publicado 2022

Photosensitive Schottky barrier diode behavior of a semiconducting Co(iii)–Na complex with a compartmental Schiff base ligand

por Ghosh, Kousik, Sil, Sayantan, Ray, Partha Pratim, Ortega-Castro, Joaquín, Frontera, Antonio, Chattopadhyay, Shouvik
Publicado 2019

Crystallographic Aspects, Photophysical Properties, and Theoretical Survey of Tetrachlorometallates of Group 12 Metals [Zn(II), Cd(II), and Hg(II)] with a Triply Protonated 2,4,6-T...

por Pramanik, Samit, Jana, Sumanta, Das, Kinsuk, Pathak, Sudipta, Ortega-Castro, Joaquin, Frontera, Antonio, Mukhopadhyay, Subrata
Publicado 2023

Synthesis, X-ray Characterization and Density Functional Theory (DFT) Studies of Two Polymorphs of the α,α,α,α, Isomer of Tetra-p-Iodophenyl Tetramethyl Calix[4]pyrrole: On the Imp...

por Dăbuleanu, Dragoș, Bauzá, Antonio, Ortega-Castro, Joaquín, Escudero-Adán, Eduardo C., Ballester, Pablo, Frontera, Antonio
Publicado 2020

Unravelling the effect of N(ε)-(carboxyethyl)lysine on the conformation, dynamics and aggregation propensity of α-synuclein

por Mariño, Laura, Ramis, Rafael, Casasnovas, Rodrigo, Ortega-Castro, Joaquín, Vilanova, Bartolomé, Frau, Juan, Adrover, Miquel
Publicado 2020

How Does Pyridoxamine Inhibit the Formation of Advanced Glycation End Products? The Role of Its Primary Antioxidant Activity

por Ramis, Rafael, Ortega-Castro, Joaquín, Caballero, Carmen, Casasnovas, Rodrigo, Cerrillo, Antonia, Vilanova, Bartolomé, Adrover, Miquel, Frau, Juan
Publicado 2019

Formation Mechanism of Inter-Crosslink in DNA by Nitrogen Oxides Pollutants through A Diazonium Intermediate

por Hernandez-Haro, Noemi, Solis-Calero, Christian, Casasnovas, Rodrigo, Morell, Christophe, Grand, Andre, Frau, Juan, Ortega-Castro, Joaquín
Publicado 2022

Influence of 2-Amino-4-methylpyridine and 2-Aminopyrimidine Ligands on the Malonic Acid-Cu(II) System: Insights through Supramolecular Interactions and Photoresponse Properties

por Mandal, Tripti, Dey, Arka, Seth, Saikat Kumar, Ortega-Castro, Joaquín, Rheingold, Arnold L., Ray, Partha Pratim, Frontera, Antonio, Mukhopadhyay, Subrata
Publicado 2019

Enhanced Photosensitive Schottky Diode Behavior of Pyrazine over 2-Aminopyrimidine Ligand in Copper(II)-Phthalate MOFs: Experimental and Theoretical Rationalization

por Hossain, Anowar, Dey, Arka, Seth, Saikat Kumar, Ray, Partha Pratim, Ballester, Pablo, Pritchard, Robin G., Ortega-Castro, Joaquín, Frontera, Antonio, Mukhopadhyay, Subrata
Publicado 2018

Structures, photoresponse properties and DNA binding abilities of 4-(4-pyridinyl)-2-pyridone salts

por Mandal, Tripti, Dey, Arka, Pathak, Sudipta, Islam, Md. Maidul, Konar, Saugata, Ortega-Castro, Joaquín, Seth, Saikat Kumar, Ray, Partha Pratim, Frontera, Antonio, Mukhopadhyay, Subrata
Publicado 2019

Structures, Photoresponse Properties, and Biological Activity of Dicyano-Substituted 4-Aryl-2-pyridone Derivatives

por Mandal, Tripti, Pathak, Sudipta, Dey, Arka, Islam, Md. Maidul, Seth, Saikat Kumar, Masum, Abdulla Al, Ortega-Castro, Joaquín, Ray, Partha Pratim, Frontera, Antonio, Mukhopadhyay, Subrata
Publicado 2019

Evaluation of Annona muricata Acetogenins as Potential Anti-SARS-CoV-2 Agents Through Computational Approaches

por Prasad, Shashanka K., Pradeep, Sushma, Shimavallu, Chandan, Kollur, Shiva Prasad, Syed, Asad, Marraiki, Najat, Egbuna, Chukwuebuka, Gaman, Mihnea-Alexandru, Kosakowska, Olga, Cho, William C., Patrick-Iwuanyanwu, Kingsley Chukwuemeka, Ortega Castro, Joaquín, Frau, Juan, Flores-Holguín, Norma, Glossman-Mitnik, Daniel
Publicado 2021

Preparation, Spectroscopic Characterization, Theoretical Investigations, and In Vitro Anticancer Activity of Cd(II), Ni(II), Zn(II), and Cu(II) Complexes of 4(3H)-Quinazolinone-Der...

por Ashok, Ubale Panchsheela, Kollur, Shiva Prasad, Anil, Nishad, Arun, Bansode Prakash, Jadhav, Sanjay Namdev, Sarsamkar, Sanjay, Helavi, Vasant Baburao, Srinivasan, Asha, Kaulage, Sandeep, Veerapur, Ravindra, Al-Rashed, Sarah, Syed, Asad, Ortega-Castro, Joaquín, Frau, Juan, Flores-Holguín, Norma, Glossman-Mitnik, Daniel
Publicado 2020

N-((1H-Pyrrol-2-yl)methylene)-6-methoxypyridin-3-amine and Its Co(II) and Cu(II) Complexes as Antimicrobial Agents: Chemical Preparation, In Vitro Antimicrobial Evaluation, In Sili...

por Mariwamy, Vinusha H., Kollur, Shiva Prasad, Shivananda, Bindya, Begum, Muneera, Shivamallu, Chandan, Dharmashekara, Chandan, Pradeep, Sushma, Jain, Anisha S., Prasad, Shashanka K., Syed, Asad, Elgorban, Abdallah M., Al-Rejaie, Salim, Ortega-Castro, Joaquín, Frau, Juan, Flores-Holguín, Norma, Glossman-Mitnik, Daniel
Publicado 2022

Synthesis, Computational Pharmacokinetics Report, Conceptual DFT-Based Calculations and Anti-Acetylcholinesterase Activity of Hydroxyapatite Nanoparticles Derived From Acorus Calam...

por Pradeep, Sushma, Jain, Anisha S., Dharmashekara, Chandan, Prasad, Shashanka K., Akshatha, Nagaraju, Pruthvish, R., Amachawadi, Raghavendra G, Srinivasa, Chandrashekar, Syed, Asad, Elgorban, Abdallah M., Al Kheraif, Abdulaziz A., Ortega-Castro, Joaquín, Frau, Juan, Flores-Holguín, Norma, Shivamallu, Chandan, Kollur, Shiva Prasad, Glossman-Mitnik, Daniel
Publicado 2021

Virtual Screening for Potential Phytobioactives as Therapeutic Leads to Inhibit NQO1 for Selective Anticancer Therapy

por Shreevatsa, Bhargav, Dharmashekara, Chandan, Swamy, Vikas Halasumane, Gowda, Meghana V., Achar, Raghu Ram, Kameshwar, Vivek Hamse, Thimmulappa, Rajesh Kumar, Syed, Asad, Elgorban, Abdallah M., Al-Rejaie, Salim S., Ortega-Castro, Joaquín, Frau, Juan, Flores-Holguín, Norma, Shivamallu, Chandan, Kollur, Shiva Prasad, Glossman-Mitnik, Daniel
Publicado 2021

Phytoconstituents of Withania somnifera unveiled Ashwagandhanolide as a potential drug targeting breast cancer: Investigations through computational, molecular docking and conceptu...

por Gowtham, Hittanahallikoppal Gajendramurthy, Murali, Mahadevamurthy, Singh, Sudarshana Brijesh, Shivamallu, Chandan, Pradeep, Sushma, Shivakumar, C. S., Anandan, Satish, Thampy, Anjana, Achar, Raghu Ram, Silina, Ekaterina, Stupin, Victor, Ortega-Castro, Joaquín, Frau, Juan, Flores-Holguín, Norma, Amruthesh, Kestur Nagaraj, Kollur, Shiva Prasad, Glossman-Mitnik, Daniel
Publicado 2022

Integrated approach for studying bioactive compounds from Cladosporium spp. against estrogen receptor alpha as breast cancer drug target

por Anandan, Satish, Gowtham, Hittanahallikoppal Gajendramurthy, Shivakumara, C. S., Thampy, Anjana, Singh, Sudarshana Brijesh, Murali, Mahadevamurthy, Shivamallu, Chandan, Pradeep, Sushma, Shilpa, Natarajamurthy, Shati, Ali A., Alfaifi, Mohammad Y., Elbehairi, Serag Eldin I., Ortega-Castro, Joaquín, Frau, Juan, Flores-Holguín, Norma, Kollur, Shiva Prasad, Glossman-Mitnik, Daniel
Publicado 2022

Author Correction: Integrated approach for studying bioactive compounds from Cladosporium spp. against estrogen receptor alpha as breast cancer drug target

por Anandan, Satish, Gowtham, Hittanahallikoppal Gajendramurthy, Shivakumara, C. S., Thampy, Anjana, Singh, Sudarshana Brijesh, Murali, Mahadevamurthy, Shivamallu, Chandan, Pradeep, Sushma, Shilpa, Natarajamurthy, Shati, Ali A., Alfaifi, Mohammad Y., Elbehairi, Serag Eldin I., Ortega‑Castro, Joaquín, Frau, Juan, Flores‑Holguín, Norma, Kollur, Shiva Prasad, Glossman‑Mitnik, Daniel
Publicado 2023