[21] | Computational Workflow for Refining AlphaFold Models in Drug Design Using Kinetic and Thermodynamic Binding Calculations: A Case Study for the Unresolved Inactive Human Adenosine A3 Receptor (Stampelou, Margarita, Ladds, Graham and Kolocouris, Antonios), In The Journal of Physical Chemistry B, volume 128, 2024. |
[20] | Molecular simulations of doxorubicin complexed with native and modified cyclodextrins in water (Georgios Mikaelian, Grigorios Megariotis, Doros N Theodorou), In Journal of Physics: Conference Series, volume 2701, 2024. |
[19] | Top-tuning on transformers and data augmentation transferring for boosting the performance of weed identification (Borja Espejo-Garcia, Hercules Panoutsopoulos, Evangelos Anastasiou, Francisco Javier Rodríguez-Rigueiroz and Spyros Fountas), In Computers and Electronics in Agriculture, volume 211, 2023. |
[18] | Benchmarking and scaling of deep learning models for land cover image classification (Ioannis Papoutsis, Nikolaos Ioannis Bountos, Angelos Zavras, Dimitrios Michail, Christos Tryfonopoulos), In ISPRS Journal of Photogrammetry and Remote Sensing, volume 195, 2023. |
[17] | Comparative Study of Receptor-, Receptor State-, and Membrane-Dependent Cholesterol Binding Sites in A2A and A1 Adenosine Receptors Using Coarse-Grained Molecular Dynamics Simulations (Tzortzini Efpraxia, Corey Robin A., Kolocouris Antonios), In Journal of Chemical Information and Modeling, volume 63, 2023. |
[16] | Synthesis and Testing of Analogs of the Tuberculosis Drug Candidate SQ109 against Bacteria and Protozoa: Identification of Lead Compounds against Mycobacterium abscessus and Malaria Parasites (Stampolaki Marianna, Malwal Satish R., Alvarez-Cabrera Nadine, Gao Zijun, Moniruzzaman Mohammad, Babii Svitlana O., Naziris Nikolaos, Rey-Cibati André, Valladares-Delgado Mariana, Turcu Andreea L., Baek Kyung-Hwa, Phan Trong-Nhat, Lee Hyeryon, Alcaraz Mattheo, Watson Savannah, van der Watt Mariette, Coertzen Dina, Efstathiou Natasa, Chountoulesi Maria, Shoen Carolyn M., Papanastasiou Ioannis P., Brea Jose, Cynamon Michael H., Birkholtz Lyn-Marié, Kremer Laurent, No Joo Hwan, Vázquez Santiago, Benaim Gustavo, Demetzos Costas, Zgurskaya Helen I., Dick Thomas, Oldfield Eric, Kolocouris Antonios D.), In ACS Infectious Diseases, volume 9, 2023. |
[15] | Bacterial Lectin FimH and Its Aggregation Hot-Spots: An Alternative Strategy against Uropathogenic Escherichia coli (Nasi Georgia I., Georgakopoulou Konstantina I., Theodoropoulou Marilena K., Papandreou Nikos C., Chrysina Evangelia D., Tsiolaki Paraskevi L., Iconomidou Vassiliki A.), In Pharmaceutics, volume 15, 2023. |
[14] | An aerosol odyssey: Navigating nutrient flux changes to marine ecosystems (Hamilton, Douglas S., Baker, Alex R., Iwamoto, Yoko, Gassó, Santiago, Bergas-Masso, Elisa, Deutch, Sarah, Dinasquet, Julie, Kondo, Yoshiko, Llort, Joan, Myriokefalitakis, Stelios, Perron, Morgane M. G., Wegmann, Alex and Yoon, Joo-Eun), In Elementa: Science of the Anthropocene, volume 11, 2023. |
[13] | Fabrication and characterisation of ZnO@TiO2 core/shell nanowires using a versatile kinetics-controlled coating growth method (Naif Ahmed Alshehri, Abdulaziz K. Assaifan, Ayed A. Albalawi, Eman H. Alghamdi, Y. Niu, C. Pleydell-Pearce, Theodore Pavloudis, Joseph Kioseoglou, Mohammed Alsawat and T.T.G. Maffeis), In Applied Surface Science, volume 594, 2022. |
[12] | Complexation of a Polyelectrolyte Brush with Oppositely Charged AB Diblock Copolymers: The Zipper Brushes (Gioldasis, Christos, Gergidis, Leonidas N. and Vlahos, Costas), In Macromolecular Theory and Simulations, volume n/a, 2022. |
[11] | A hybrid Lagrangian–Eulerian flow solver applied to elastically mounted cylinders in tandem arrangement (George Papadakis, Vasilis A. Riziotis and Spyros G. Voutsinas), In Journal of Fluids and Structures, volume 113, 2022. |
[10] | Discovery of a High Affinity Adenosine A1/A3 Receptor Antagonist with a Novel 7-Amino-pyrazolo[3,4-d]pyridazine Scaffold (Suchankova, Anna, Stampelou, Margarita, Koutsouki, Klontiana, Pousias, Athanasios, Dhingra, Lakshiv, Barkan, Kerry, Pouli, Nicole, Marakos, Panagiotis, Tenta, Roxane, Kolocouris, Antonios, Lougiakis, Nikolaos and Ladds, Graham), In ACS Medicinal Chemistry Letters, volume 0, 2022. |
[9] | A Localized Enantioselective Catalytic Site on Short DNA Sequences and Their Amphiphiles (Guo Jun, Wang Danyu, Pantatosaki Evangelia, Kuang Huihui, Papadopoulos George K., Tsapatsis Michael, Kokkoli Efrosini), In JACS Au, volume 2, 2022. |
[8] | Modulating the growth of chemically deposited ZnO nanowires and the formation of nitrogen- and hydrogen-related defects using pH adjustment (Villafuerte, José, Sarigiannidou, Eirini, Donatini, Fabrice, Kioseoglou, Joseph, Chaix-Pluchery, Odette, Pernot, Julien and Consonni, Vincent), In Nanoscale Adv., volume 4, 2022. |
[7] | Ab initio, artificial neural network predictions and experimental synthesis of mischmetal alloying in Sm–Co permanent magnets (Giaremis, Stefanos, Katsikas, Georgios, Sempros, Georgios, Gjoka, Margarit, Sarafidis, Charalambos and Kioseoglou, Joseph), In Nanoscale, The Royal Society of Chemistry, volume 14, 2022. |
[6] | Cost effective modification of SmCo5-type alloys (Sempros,Georgios, Sarafidis,Charalampos, Giaremis,Stefanos, Kioseoglou,Joseph and Gjoka,Margarit), In AIP Advances, volume 12, 2022. |
[5] | Quantification of Nanoscale Dose Enhancement in Gold Nanoparticle-Aided External Photon Beam Radiotherapy (Vlastou, Elena, Pantelis, Evaggelos, Efstathopoulos, Efstathios P., Karaiskos, Pantelis, Kouloulias, Vasileios and Platoni, Kalliopi), In Cancers, volume 14, 2022. |
[4] | p-Type Iodine-Doping of Cu3N and Its Conversion to γ-CuI for the Fabrication of γ-CuI/Cu3N p-n Heterojunctions (Tilemachou, Argyris, Zervos, Matthew, Othonos, Andreas, Pavloudis, Theodoros and Kioseoglou, Joseph), In Electronic Materials, volume 3, 2022. |
[3] | Machine Learning in Magnetic Materials (Katsikas, Georgios, Sarafidis, Charalampos and Kioseoglou, Joseph), In physica status solidi (b), volume 258, 2021. |
[2] | Structural and magnetic properties of SmCo5−XNiX intermetallic compounds (E. Antoniou, G. Sempros, M. Gjoka, C. Sarafidis, H.M. Polatoglou, J. Kioseoglou), In Journal of Alloys and Compounds, volume 882, 2021. |
[1] | Thermodynamic analysis of oligomeric blends by applying the Kirkwood-Buff theory of solutions (Fotis Venetsanos, Stefanos D. Anogiannakis and Doros N. Theodorou), In Journal of Physics: Conference Series, IOP Publishing, volume 2090, 2021. |