1. A computational study of photonic materials based on Ni bis(dithiolene) fused with benzene, possessing gigantic second hyperpolarizabilities. Issue 1 (8th December 2017) Authors: Avramopoulos, Aggelos; Otero, Nicolás; Reis, Heribert; Karamanis, Panaghiotis; Papadopoulos, Manthos G. Journal: Journal of materials chemistry Issue: Volume 6:Issue 1(2017) Page Start: 91 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. A Twisted Bay‐Substituted Quaterrylene Phosphorescing in the NIR Spectral Region. Issue 11 (24th October 2017) Authors: Miletić, Tanja; Fermi, Andrea; Papadakis, Ioannis; Orfanos, Ioannis; Karampitsos, Nikolaos; Avramopoulos, Aggelos; Demitri, Nicola; De Leo, Federica; Pope, Simon J. A.; Papadopoulos, Manthos G.; Couris, Stelios; Bonifazi, Davide Journal: Helvetica chimica acta Issue: Volume 100:Issue 11(2017) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Biological and computational evaluation of resveratrol inhibitors against Alzheimer's disease. (2nd January 2016) Authors: Koukoulitsa, Catherine; Villalonga-Barber, Caroline; Csonka, Robert; Alexi, Xanthippi; Leonis, Georgios; Dellis, Dimitris; Hamelink, Elizabeth; Belda, Oscar; Steele, Barry R.; Micha-Screttas, Maria; Alexis, Michael N.; Papadopoulos, Manthos G.; Mavromoustakos, Thomas Journal: Journal of enzyme inhibition and medicinal chemistry Issue: Volume 31:Number 1(2016:Feb.) Page Start: 67 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Development of a potent 2-oxoamide inhibitor of secreted phospholipase A2 guided by molecular docking calculations and molecular dynamics simulations. Issue 8 (15th April 2016) Authors: Vasilakaki, Sofia; Barbayianni, Efrosini; Leonis, Georgios; Papadopoulos, Manthos G.; Mavromoustakos, Thomas; Gelb, Michael H.; Kokotos, George Journal: Bioorganic & medicinal chemistry Issue: Volume 24:Issue 8(2016) Page Start: 1683 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Discovery of HIV Type 1 Aspartic Protease Hit Compounds through Combined Computational Approaches. (14th July 2016) Authors: Xanthopoulos, Dimitrios; Kritsi, Eftichia; Supuran, Claudiu T.; Papadopoulos, Manthos G.; Leonis, Georgios; Zoumpoulakis, Panagiotis Journal: ChemMedChem Issue: Volume 11:Number 15(2016) Page Start: 1646 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. Ni Dithiolenes – A Theoretical Study on Structure–Property Relationships. Issue 27 (24th July 2013) Authors: Avramopoulos, Aggelos; Reis, Heribert; Mousdis, George A.; Papadopoulos, Manthos G. Journal: European journal of inorganic chemistry Issue: Issue 27(2013) Page Start: 4839 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. On the Vibrational linear and nonlinear optical properties of compounds involving noble gas atoms: HXeOXeH, HXeOXeF, and FXeOXeF. Issue 17 (3rd April 2013) Authors: Avramopoulos, Aggelos; Reis, Heribert; Luis, Josep M.; Papadopoulos, Manthos G. Journal: Journal of computational chemistry Issue: Volume 34:Issue 17(2013) Page Start: 1446 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. Performance of density functional theory in computing nonresonant vibrational (hyper)polarizabilities. Issue 20 (16th May 2013) Authors: Bulik, Ireneusz W.; Zaleśny, Robert; Bartkowiak, Wojciech; Luis, Josep M.; Kirtman, Bernard; Scuseria, Gustavo E.; Avramopoulos, Aggelos; Reis, Heribert; Papadopoulos, Manthos G. Journal: Journal of computational chemistry Issue: Volume 34:Issue 20(2013) Page Start: 1775 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. Significant nonlinear‐optical switching capacity in atomic clusters built from silicon and lithium: A combined ab initio and density functional study. Issue 11 (12th February 2014) Authors: Karamanis, Panaghiotis; Otero, Nicolás; Pouchan, Claude; Torres, Juan José; Tiznado, William; Avramopoulos, Aggelos; Papadopoulos, Manthos G. Journal: Journal of computational chemistry Issue: Volume 35:Issue 11(2014) Page Start: 829 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. Stability and binding effects of silver(I) complexes at lipoxygenase-1. (August 2015) Authors: Vrontaki, Eleni; Leonis, Georgios; Avramopoulos, Aggelos; Papadopoulos, Manthos G.; Simčič, Mihael; Grdadolnik, Simona Golič; Afantitis, Antreas; Melagraki, Georgia; Hadjikakou, Sotiris K.; Mavromoustakos, Thomas Journal: Journal of enzyme inhibition and medicinal chemistry Issue: Volume 30:Number 4(2015:Aug.) Page Start: 539 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗