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| Title : Slight difference in the isomeric oximes K206 and K203 makes huge difference for the reactivation of organophosphorus-inhibited AChE: Theoretical and experimental aspects - Polisel_2019_Chem.Biol.Interact_13ChEPon_309_108671 |
| Author(s) : Polisel DA , de Castro AA , Mancini DT , da Cunha EFF , Franca TCC , Ramalho TC , Kuca K |
| Ref : Chemico-Biological Interactions , 309 :108671 , 2019 |
| Abstract : Polisel_2019_Chem.Biol.Interact_13ChEPon_309_108671 |
| ESTHER : Polisel_2019_Chem.Biol.Interact_13ChEPon_309_108671 |
| PubMedSearch : Polisel_2019_Chem.Biol.Interact_13ChEPon_309_108671 |
| PubMedID: 31207225 |
| Title : Development of technologies applied to the biodegradation of warfare nerve agents: Theoretical evidence for asymmetric homogeneous catalysis - Pereira_2019_Chem.Biol.Interact_13ChEPon_308_323 |
| Author(s) : Pereira AF , de Castro AA , Soares FV , Soares Leal DH , da Cunha EFF , Mancini DT , Ramalho TC |
| Ref : Chemico-Biological Interactions , 308 :323 , 2019 |
| Abstract : Pereira_2019_Chem.Biol.Interact_13ChEPon_308_323 |
| ESTHER : Pereira_2019_Chem.Biol.Interact_13ChEPon_308_323 |
| PubMedSearch : Pereira_2019_Chem.Biol.Interact_13ChEPon_308_323 |
| PubMedID: 31173750 |
| Title : Asymmetric biodegradation of the nerve agents Sarin and VX by human dUTPase: Chemometrics, Molecular Docking and Hybrid QM\/MM calculations - de Castro_2018_J.Biomol.Struct.Dyn__1 |
| Author(s) : de Castro AA , Soares FV , Pereira AF , Silva TC , Silva DR , Mancini DT , Caetano MS , da Cunha EFF , Ramalho TC |
| Ref : J Biomol Struct Dyn , :1 , 2018 |
| Abstract : de Castro_2018_J.Biomol.Struct.Dyn__1 |
| ESTHER : de Castro_2018_J.Biomol.Struct.Dyn__1 |
| PubMedSearch : de Castro_2018_J.Biomol.Struct.Dyn__1 |
| PubMedID: 30044197 |
| Title : Theoretical Studies Applied to the Evaluation of the DFPase Bioremediation Potential against Chemical Warfare Agents Intoxication - Soares_2018_Int.J.Mol.Sci_19_ |
| Author(s) : Soares FV , de Castro AA , Pereira AF , Leal DHS , Mancini DT , Krejcar O , Ramalho TC , da Cunha EFF , Kuca K |
| Ref : Int J Mol Sci , 19 : , 2018 |
| Abstract : Soares_2018_Int.J.Mol.Sci_19_ |
| ESTHER : Soares_2018_Int.J.Mol.Sci_19_ |
| PubMedSearch : Soares_2018_Int.J.Mol.Sci_19_ |
| PubMedID: 29690585 |
| Title : Molecular Docking, Metal Substitution and Hydrolysis Reaction of Chiral Substrates of Phosphotriesterase - de Castro_2016_Comb.Chem.High.Throughput.Screen_19_334 |
| Author(s) : de Castro AA , Caetano MS , Silva TC , Mancini DT , Rocha EP , da Cunha EFF , Ramalho TC |
| Ref : Comb Chem High Throughput Screen , 19 :334 , 2016 |
| Abstract : de Castro_2016_Comb.Chem.High.Throughput.Screen_19_334 |
| ESTHER : de Castro_2016_Comb.Chem.High.Throughput.Screen_19_334 |
| PubMedSearch : de Castro_2016_Comb.Chem.High.Throughput.Screen_19_334 |
| PubMedID: 27012528 |
| Title : Molecular modeling and in vitro reactivation study between the oxime BI-6 and acetylcholinesterase inhibited by different nerve agents - Giacoppo_2015_J.Biomol.Struct.Dyn_33_2048 |
| Author(s) : Giacoppo JO , Franca TCC , Kuca K , da Cunha EFF , Abagyan R , Mancini DT , Ramalho TC |
| Ref : J Biomol Struct Dyn , 33 :2048 , 2015 |
| Abstract : Giacoppo_2015_J.Biomol.Struct.Dyn_33_2048 |
| ESTHER : Giacoppo_2015_J.Biomol.Struct.Dyn_33_2048 |
| PubMedSearch : Giacoppo_2015_J.Biomol.Struct.Dyn_33_2048 |
| PubMedID: 25407587 |