Search Results - Wade, Rebecca C.
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S100A1ct: a synthetic peptide derived from S100A1 protein improves cardiac performance and survival in preclinical heart failure models by Kehr, Dorothea (Author) , Ritterhoff, Julia (Author) , Glaser, Manuel (Author) , Jarosch, Lukas (Author) , Salazar, Rafael E. (Author) , Spaich, Kristin (Author) , Varadi, Karl (Author) , Birkenstock, Jennifer (Author) , Egger, Michael (Author) , Gao, Erhe (Author) , Koch, Walter J. (Author) , Sauter, Max (Author) , Freichel, Marc (Author) , Katus, Hugo (Author) , Frey, Norbert (Author) , Jungmann, Andreas (Author) , Busch, Cornelius (Author) , Mather, Paul J. (Author) , Ruhparwar, Arjang (Author) , Busch, Martin (Author) , Völkers, Mirko (Author) , Wade, Rebecca C. (Author) , Most, Patrick (Author) ,
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On the determinants of electron transfer reorganization energy in a cytochrome P450: cytochrome b5 complex: A combined quantum mechanics and molecular dynamics simulation study by Teuffel, Jonathan (Author) , Mukherjee, Goutam (Author) , Han, Sungho Bosco (Author) , Elstner, Marcus (Author) , Wade, Rebecca C. (Author) ,
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Design of nanobody targeting SARS-CoV-2 spike glycoprotein using CDR-grafting assisted by molecular simulation and machine learning by Ferraz, Matheus (Author) , Adan, W. Camilla S. (Author) , Lima, Tayná E. (Author) , Santos, Adriele J. C. (Author) , Paula, Sérgio O. de (Author) , Dhalia, Rafael (Author) , Wallau, Gabriel L. (Author) , Wade, Rebecca C. (Author) , Viana, Isabelle F. T. (Author) , Lins, Roberto D. (Author) ,
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Editorial: the Journal of molecular recognition : changing of the guard by Wade, Rebecca C. (Author)
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Impact of an irreversible β-galactosylceramidase inhibitor on the lipid profile of zebrafish embryos by Guerra, Jessica (Author) , Belleri, Mirella (Author) , Paiardi, Giulia (Author) , Tobia, Chiara (Author) , Capoferri, Davide (Author) , Corli, Marzia (Author) , Scalvini, Elisa (Author) , Ghirimoldi, Marco (Author) , Manfredi, Marcello (Author) , Wade, Rebecca C. (Author) , Presta, Marco (Author) , Mignani, Luca (Author) ,
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Myotubularin-related-protein-7 inhibits mutant (G12V) K-RAS by direct interaction by Weidner, Philip (Author) , Saar, Daniel (Author) , Söhn, Michaela (Author) , Schroeder, Torsten (Author) , Yu, Yanxiong (Author) , Zöllner, Frank G. (Author) , Ponelies, Norbert (Author) , Zhou, Xiao-Bo (Author) , Zwicky, André (Author) , Rohrbacher, Florian N. (Author) , Pattabiraman, Vijaya R. (Author) , Tanriver, Matthias (Author) , Bauer, Alexander (Author) , Ahmed, Hazem (Author) , Ametamey, Simon M. (Author) , Riffel, Philipp (Author) , Seger, Rony (Author) , Bode, Jeffrey W. (Author) , Wade, Rebecca C. (Author) , Ebert, Matthias (Author) , Kragelund, Birthe B. (Author) , Burgermeister, Elke (Author) ,
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Comprehensive characterization of the neurogenic and neuroprotective action of a novel TrkB agonist using mouse and human stem cell models of Alzheimer’s disease by Charou, Despoina (Author) , Rogdakis, Thanasis (Author) , Latorrata, Alessia (Author) , Valcarcel, Maria (Author) , Papadogiannis, Vasileios (Author) , Athanasiou, Christina (Author) , Tsengenes, Alexandros (Author) , Papadopoulou, Maria Anna (Author) , Lypitkas, Dimitrios (Author) , Lavigne, Matthieu D. (Author) , Katsila, Theodora (Author) , Wade, Rebecca C. (Author) , Cader, M. Zameel (Author) , Calogeropoulou, Theodora (Author) , Gravanis, Achille (Author) , Charalampopoulos, Ioannis (Author) ,
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Multiresolution molecular dynamics simulations reveal the interplay between conformational variability and functional interactions in membrane-bound cytochrome P450 2B4 by Han, Sungho Bosco (Author) , Teuffel, Jonathan (Author) , Mukherjee, Goutam (Author) , Wade, Rebecca C. (Author) ,
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Computational screening of the effects of mutations on protein-protein off-rates and dissociation mechanisms by τRAMD by D'Arrigo, Giulia (Author) , Kokh, Daria B. (Author) , Nunes-Alves, Ariane (Author) , Wade, Rebecca C. (Author) ,
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The accomplices: Heparan sulfates and N-glycans foster SARS-CoV-2 spike:ACE2 receptor binding and virus priming by Paiardi, Giulia (Author) , Ferraz, Matheus (Author) , Rusnati, Marco (Author) , Wade, Rebecca C. (Author) ,
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PfCRT mutations conferring piperaquine resistance in falciparum malaria shape the kinetics of quinoline drug binding and transport by Gómez, Guillermo (Author) , D’Arrigo, Giulia (Author) , Sanchez, Cecilia P. (Author) , Berger, Fiona (Author) , Wade, Rebecca C. (Author) , Lanzer, Michael (Author) ,
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An engineered variant of MECR reductase reveals indispensability of long-chain acyl-ACPs for mitochondrial respiration by Tanvir Rahman, Mohammad (Author) , Koski, M. Kristian (Author) , Panecka-Hofman, Joanna (Author) , Schmitz, Werner (Author) , Kastaniotis, Alexander J. (Author) , Wade, Rebecca C. (Author) , Wierenga, Rik K. (Author) , Kalervo Hiltunen, J. (Author) , Autio, Kaija J. (Author) ,
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Design, synthesis and biological evaluation of antiparasitic dinitroaniline-ether phospholipid hybrids by Roussaki, Marina (Author) , Magoulas, George E. (Author) , Fotopoulou, Theano (Author) , Santarem, Nuno (Author) , Barrias, Emile (Author) , Pöhner, Ina (Author) , Luelmo, Sara (Author) , Afroudakis, Pantelis (Author) , Georgikopoulou, Kalliopi (Author) , Nevado, Paloma Tejera (Author) , Eick, Julia (Author) , Bifeld, Eugenia (Author) , Corral, María J. (Author) , Jiménez-Antón, María Dolores (Author) , Ellinger, Bernhard (Author) , Kuzikov, Maria (Author) , Fragiadaki, Irini (Author) , Scoulica, Effie (Author) , Gul, Sheraz (Author) , Clos, Joachim (Author) , Prousis, Kyriakos C. (Author) , Torrado, Juan J. (Author) , Alunda, José María (Author) , Wade, Rebecca C. (Author) , de Souza, Wanderley (Author) , Cordeiro da Silva, Anabela (Author) , Calogeropoulou, Theodora (Author) ,
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Comparative analysis of drug-salt-polymer interactions by experiment and molecular simulation improves biopharmaceutical performance by Mukesh, Sumit (Author) , Mukherjee, Goutam (Author) , Singh, Ridhima (Author) , Steenbuck, Nathan (Author) , Demidova, Carolina (Author) , Joshi, Prachi (Author) , Sangamwar, Abhay T. (Author) , Wade, Rebecca C. (Author) ,
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The binding of heparin to spike glycoprotein inhibits SARS-CoV-2 infection by three mechanisms by Paiardi, Giulia (Author) , Richter, Stefan (Author) , Oreste, Pasqua (Author) , Urbinati, Chiara (Author) , Rusnati, Marco (Author) , Wade, Rebecca C. (Author) ,
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The non-phosphorylating glyceraldehyde-3-phosphate dehydrogenase GapN is a potential new drug target in Streptococcus pyogenes by Eisenberg, Philip (Author) , Albert, Leon (Author) , Teuffel, Jonathan (Author) , Zitzow, Eric (Author) , Michaelis, Claudia (Author) , Jarick, Jane (Author) , Sehlke, Clemens (Author) , Große, Lisa (Author) , Bader, Nicole (Author) , Nunes-Alves, Ariane (Author) , Kreikemeyer, Bernd (Author) , Schindelin, Hermann (Author) , Wade, Rebecca C. (Author) , Fiedler, Tomas (Author) ,
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Combining hypothesis- and data-driven neuroscience modeling in FAIR workflows by Eriksson, Olivia (Author) , Bhalla, Upinder Singh (Author) , Blackwell, Kim T. (Author) , Crook, Sharon M. (Author) , Keller, Daniel (Author) , Kramer, Andrei (Author) , Linne, Marja-Leena (Author) , Saudargienė, Ausra (Author) , Wade, Rebecca C. (Author) , Hellgren Kotaleski, Jeanette (Author) ,
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Multitarget, selective compound design yields potent inhibitors of a kinetoplastid pteridine reductase 1 by Pöhner, Ina (Author) , Quotadamo, Antonio (Author) , Panecka-Hofman, Joanna (Author) , Luciani, Rosaria (Author) , Santucci, Matteo (Author) , Linciano, Pasquale (Author) , Landi, Giacomo (Author) , Di Pisa, Flavio (Author) , Dello Iacono, Lucia (Author) , Pozzi, Cecilia (Author) , Mangani, Stefano (Author) , Gul, Sheraz (Author) , Witt, Gesa (Author) , Ellinger, Bernhard (Author) , Kuzikov, Maria (Author) , Santarem, Nuno (Author) , Cordeiro-da-Silva, Anabela (Author) , Costi, Maria P. (Author) , Venturelli, Alberto (Author) , Wade, Rebecca C. (Author) ,
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Development and biological characterization of a novel selective TrkA agonist with neuroprotective properties against amyloid toxicity by Rogdakis, Thanasis (Author) , Charou, Despoina (Author) , Latorrata, Alessia (Author) , Papadimitriou, Eleni (Author) , Tsengenes, Alexandros (Author) , Athanasiou, Christina (Author) , Papadopoulou, Marianna (Author) , Chalikiopoulou, Constantina (Author) , Katsila, Theodora (Author) , Ramos, Isbaal (Author) , Prousis, Kyriakos C. (Author) , Wade, Rebecca C. (Author) , Sidiropoulou, Kyriaki (Author) , Calogeropoulou, Theodora (Author) , Gravanis, Achille (Author) , Charalampopoulos, Ioannis (Author) ,
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Match Tope: a tool to predict the cross reactivity of peptides complexed with Major Histocompatibility Complex I by Mendes de Almeida, Marcus Fabiano (Author) , Souza Bragatte, Marcelo de (Author) , Vianna, Priscila (Author) , Freitas, Martiela Vaz de (Author) , Pöhner, Ina (Author) , Richter, Stefan (Author) , Wade, Rebecca C. (Author) , Salzano, Francisco Mauro (Author) , Vieira, Gustavo Fioravanti (Author) ,
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Related Subjects
molecular dynamics
molecular dynamics simulation
cytochrome P450
protein dynamics
Actin filaments
Actins
Biochemical simulations
Brownian dynamics
CYP51
Hydrogen bonding
Molecular Dynamics Simulation
NMR
Neurosciences
Parasitic life cycles
Plasmodium
Protein design
Proteins
Sporozoites
X-ray crystallography
chromatin
chromatosome
heparan sulfate
heparin
linker histone
machine learning
macromolecular association
membrane protein
molecular docking
molecular modeling
nucleosome