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The Fragment Molecular Orbital Method Reveals New Insight into the Chemical Nature of GPCR-Ligand Interactions.

A. Heifetz, E. Chudyk, L. Gleave, M. Aldeghi, V. Cherezov, D. Fedorov, P. Biggin, and M. Bodkin. J. Chem. Inf. Model., 56 (1): 159-172 (2016)

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Michael J Thate

Michael J Grabher

Michael J Munkert

Michael J Vellekoop

Michael J Schramm

Other publications of authors with the same name

Enhancing reaction-based de novo design using a multi-label reaction class recommender.G. Ghiandoni, M. Bodkin, B. Chen, D. Hristozov, J. Wallace, J. Webster, and V. Gillet. J. Comput. Aided Mol. Des., 34 (7): 783-803 (2020)3D QSAR Methods: Phase and Catalyst Compared.D. Evans, T. Doman, D. Thorner, and M. Bodkin. J. Chem. Inf. Model., 47 (3): 1248-1257 (2007)Learning protein-ligand binding affinity with atomic environment vectors.R. Meli, A. Anighoro, M. Bodkin, G. Morris, and P. Biggin. J. Cheminformatics, 13 (1): 59 (2021)Statistical Analysis on the Performance of Molecular Mechanics Poisson-Boltzmann Surface Area versus Absolute Binding Free Energy Calculations: Bromodomains as a Case Study.M. Aldeghi, M. Bodkin, S. Knapp, and P. Biggin. J. Chem. Inf. Model., 57 (9): 2203-2221 (September 2017)Rapid and accurate assessment of GPCR-ligand interactions Using the fragment molecular orbital-based density-functional tight-binding method.I. Morao, D. Fedorov, R. Robinson, M. Southey, A. Townsend-Nicholson, M. Bodkin, and A. Heifetz. J. Comput. Chem., 38 (23): 1987-1990 (2017)Knowledge-Based Approach to de Novo Design Using Reaction Vectors.H. Patel, M. Bodkin, B. Chen, and V. Gillet. Journal of Chemical Information and Modeling, 49 (5): 1163-1184 (2009)The Fragment Molecular Orbital Method Reveals New Insight into the Chemical Nature of GPCR-Ligand Interactions.A. Heifetz, E. Chudyk, L. Gleave, M. Aldeghi, V. Cherezov, D. Fedorov, P. Biggin, and M. Bodkin. J. Chem. Inf. Model., 56 (1): 159-172 (2016)Development and Application of a Data-Driven Reaction Classification Model: Comparison of an Electronic Lab Notebook and Medicinal Chemistry Literature.G. Ghiandoni, M. Bodkin, B. Chen, D. Hristozov, J. Wallace, J. Webster, and V. Gillet. J. Chem. Inf. Model., 59 (10): 4167-4187 (2019)

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Disambiguation of "Bodkin, Michael J."

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The Fragment Molecular Orbital Method Reveals New Insight into the Chemical Nature of GPCR-Ligand Interactions.

Please choose a person to relate this publication to

Michael J Thate

Michael J Grabher

Michael J Munkert

Michael J Vellekoop

Michael J Schramm

Other publications of authors with the same name

Disambiguation

BibSonomy

Disambiguation of "Bodkin, Michael J."

copydeleteadd this publication to your clipboardcommunity posthistory of this postURLDOIBibTeXEndNoteAPAChicagoDIN 1505HarvardMSOffice XML The Fragment Molecular Orbital Method Reveals New Insight into the Chemical Nature of GPCR-Ligand Interactions.

Please choose a person to relate this publication to

Michael J Thate

Michael J Grabher

Michael J Munkert

Michael J Vellekoop

Michael J Schramm

Other publications of authors with the same name

Disambiguation

copy delete add this publication to your clipboard
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history of this post
URL
DOI
BibTeX
EndNote
APA
Chicago
DIN 1505
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The Fragment Molecular Orbital Method Reveals New Insight into the Chemical Nature of GPCR-Ligand Interactions.