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ΤύποςΗμερομηνίαΤίτλοςΔημιουργόςΠλήρες κείμενο
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2013A contribution to the drug resistance mechanism of darunavir, amprenavir, indinavir, and saquinavir complexes with HIV-1 protease due to flap mutation I50V: A systematic MM-PBSA and thermodynamic integration studyLeonis G.; Steinbrecher T.; Papadopoulos M.G.
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2013A comparative molecular dynamics, MM-PBSA and thermodynamic integration study of saquinavir complexes with wild-type HIV-1 PR and L10I, G48V, L63P, A71V, G73S, V82A and I84V single mutantsTzoupis H.; Leonis G.; Mavromoustakos T.; Papadopoulos M.G.
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2014Elucidation of conformational states, dynamics, and mechanism of binding in human κ-opioid receptor complexesLeonis G.; Avramopoulos A.; Salmas R.E.; Durdagi S.; Yurtsever M.; Papadopoulos M.G.
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2015Investigation of the interactions of silibinin with 2-hydroxypropyl-β-cyclodextrin through biophysical techniques and computational methodsKellici T.F.; Ntountaniotis D.; Leonis G.; Chatziathanasiadou M.; Chatzikonstantinou A.V.; Becker-Baldus J.; Glaubitz C.; Tzakos A.G.; Viras K.; Chatzigeorgiou P.; Tzimas S.; Kefala E.; Valsami G.; Archontaki H.; Papadopoulos M.G.; Mavromoustakos T.
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2015Stability and binding effects of silver(I) complexes at lipoxygenase-1Vrontaki E.; Leonis G.; Avramopoulos A.; Papadopoulos M.G.; Simčič M.; Grdadolnik S.G.; Afantitis A.; Melagraki G.; Hadjikakou S.K.; Mavromoustakos T.
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2016Discovery of HIV Type 1 Aspartic Protease Hit Compounds through Combined Computational ApproachesXanthopoulos D.; Kritsi E.; Supuran C.T.; Papadopoulos M.G.; Leonis G.; Zoumpoulakis P.
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2016Development of a potent 2-oxoamide inhibitor of secreted phospholipase A2 guided by molecular docking calculations and molecular dynamics simulationsVasilakaki S.; Barbayianni E.; Leonis G.; Papadopoulos M.G.; Mavromoustakos T.; Gelb M.H.; Kokotos G.
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2016Biological and computational evaluation of resveratrol inhibitors against Alzheimers diseaseKoukoulitsa C.; Villalonga-Barber C.; Csonka R.; Alexi X.; Leonis G.; Dellis D.; Hamelink E.; Belda O.; Steele B.R.; Micha-Screttas M.; Alexis M.N.; Papadopoulos M.G.; Mavromoustakos T.
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