Combining Docking, Molecular Dynamics and the Linear Interaction Energy Method to Predict Binding Modes and Affinities for Non-nucleoside Inhibitors to HIV-1 Reverse Transcriptase
Carlsson, Jens, Boukharta, Lars, Åqvist, Johan
Published in Journal of medicinal chemistry (08.05.2008)
Published in Journal of medicinal chemistry (08.05.2008)
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Journal Article
Creation of a Novel Class of Potent and Selective MutT Homologue 1 (MTH1) Inhibitors Using Fragment-Based Screening and Structure-Based Drug Design
Rahm, Fredrik, Viklund, Jenny, Trésaugues, Lionel, Ellermann, Manuel, Giese, Anja, Ericsson, Ulrika, Forsblom, Rickard, Ginman, Tobias, Günther, Judith, Hallberg, Kenth, Lindström, Johan, Persson, Lars Boukharta, Silvander, Camilla, Talagas, Antoine, Díaz-Sáez, Laura, Fedorov, Oleg, Huber, Kilian V. M, Panagakou, Ioanna, Siejka, Paulina, Gorjánácz, Mátyás, Bauser, Marcus, Andersson, Martin
Published in Journal of medicinal chemistry (22.03.2018)
Published in Journal of medicinal chemistry (22.03.2018)
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Journal Article
Toward a Consensus Model of the hERG Potassium Channel
Stary, Anna, Wacker, Sören J., Boukharta, Lars, Zachariae, Ulrich, Karimi-Nejad, Yasmin, Åqvist, Johan, Vriend, Gert, de Groot, Bert L.
Published in ChemMedChem (01.03.2010)
Published in ChemMedChem (01.03.2010)
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Journal Article
Computer Simulations of Structure–Activity Relationships for hERG Channel Blockers
Boukharta, Lars, Keränen, Henrik, Stary-Weinzinger, Anna, Wallin, Göran, de Groot, Bert L, Åqvist, Johan
Published in Biochemistry (Easton) (12.07.2011)
Published in Biochemistry (Easton) (12.07.2011)
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Journal Article
Predicting Binding Modes from Free Energy Calculations
Nervall, Martin, Hanspers, Peter, Carlsson, Jens, Boukharta, Lars, Åqvist, Johan
Published in Journal of medicinal chemistry (08.05.2008)
Published in Journal of medicinal chemistry (08.05.2008)
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Journal Article
Interactions of human NPY/PYY C-terminal pentapeptide with the human Y2 receptor
Xu, Bo, Boukharta, Lars, Pruner, Jasna, Lundell, Ingrid, Mohell, Nina, Gutiérrez-de-Terán, Hugo, Åqvist, Johan, Larhammar, Dan
Published in Neuropeptides (Edinburgh) (01.02.2016)
Published in Neuropeptides (Edinburgh) (01.02.2016)
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Journal Article
Mutagenesis and Homology Modeling of the Tn 21 Integron Integrase IntI1
Johansson, Carolina, Boukharta, Lars, Eriksson, Jens, Åqvist, Johan, Sundström, Lars
Published in Biochemistry (Easton) (03.03.2009)
Published in Biochemistry (Easton) (03.03.2009)
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Journal Article
Conformational Flexibility of the hERG K+ Channel Pore Domain
Weinzinger, Anna, Knape, Kirsten, Wacker, Sören J., Boukharta, Lars, de Groot, Bert L.
Published in Biophysical journal (01.01.2010)
Published in Biophysical journal (01.01.2010)
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Journal Article
Mutagenesis and Homology Modeling of the Tn21 Integron Integrase IntI1
Johansson, Carolina, Boukharta, Lars, Eriksson, Jens, Åqvist, Johan, Sundström, Lars
Published in Biochemistry (Easton) (03.03.2009)
Published in Biochemistry (Easton) (03.03.2009)
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Journal Article
Mutagenesis of human neuropeptide Y/peptide YY receptor Y2 reveals additional differences to Y1 in interactions with highly conserved ligand positions
Åkerberg, Helena, Fällmar, Helena, Sjödin, Paula, Boukharta, Lars, Gutiérrez-de-Terán, Hugo, Lundell, Ingrid, Mohell, Nina, Larhammar, Dan
Published in Regulatory peptides (09.08.2010)
Published in Regulatory peptides (09.08.2010)
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Journal Article
CHROMENOPYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS
GERASYUTO, Aleksey I, HICKEY, Eugene R, LINDSTRÖM, Johan, VIKLUND, Jenny, FORSBLOM, Rickard, PERSSON, Lars Boukharta, KESICKI, Edward A, GINMAN, Tobias, DAHLGREN, Markus K
Year of Publication 12.06.2024
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Year of Publication 12.06.2024
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