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Proceedings of the National Academy of Sciences of the United States of America
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November 20, 2024
Predicting multiple conformations of ligand binding sites in proteins suggests that AlphaFold2 may remember too much
Maria Lazou, Omeir Khan, Thu Nguyen, et al.
JCI Insight
|
September 22, 2022
Preclinical testing of dabigatran in trypsin-dependent pancreatitis
Zsófia Gabriella Pesei, Zsanett Jancsó, Alexandra Demcsák, et al.
Journal of Software Engineering and Applications
|
December 26, 2022
API Development Increases Access to Shared Computing Resources at Boston University
George Jones, Amanda E Wakefield, Jeff Triplett, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
March 4, 2026
Bias in the AlphaFold3 prediction of ligand-induced domain motion in enzymes
Hao Yu, Ayse A Bekar-Cesaretli, Maria Lazou, et al.
Journal of Chemical Information and Modeling
|
August 22, 2025
Impact of Protein Conformational Diversity on Structure-Based Prediction of Druggability
Ayse A Bekar-Cesaretli, Shray Vats, Adrian Whitty, et al.
Journal of Chemical Information and Modeling
|
January 22, 2024
Conservation of Hot Spots and Ligand Binding Sites in Protein Models by AlphaFold2
Ayse A Bekar-Cesaretli, Omeir Khan, Thu Nguyen, et al.
Proteins
|
August 14, 2009
Structural insights into recognition of beta2-glycoprotein I by the lipoprotein receptors
Dmitri Beglov, Chang-Jin Lee, Alfredo De Biasio, et al.
Proteins
|
September 3, 2013
How good is automated protein docking?
Dima Kozakov, Dmitri Beglov, Tanggis Bohnuud, et al.
Nature Chemical Biology
|
July 21, 2014
How proteins bind macrocycles
Elizabeth A Villar, Dmitri Beglov, Spandan Chennamadhavuni, et al.
Journal of Chemical Theory and Computation
|
October 21, 2014
Efficient Maintenance and Update of Nonbonded Lists in Macromolecular Simulations
Rezaul Chowdhury, Dmitri Beglov, Mohammad Moghadasi, et al.
Page
of 17
Search research articles
Search
Showing results (91-100 of 165) with videos related to
Sort By:
Page
of 17
Proceedings of the National Academy of Sciences of the United States of America
|
November 20, 2024
Predicting multiple conformations of ligand binding sites in proteins suggests that AlphaFold2 may remember too much
Maria Lazou, Omeir Khan, Thu Nguyen, et al.
JCI Insight
|
September 22, 2022
Preclinical testing of dabigatran in trypsin-dependent pancreatitis
Zsófia Gabriella Pesei, Zsanett Jancsó, Alexandra Demcsák, et al.
Journal of Software Engineering and Applications
|
December 26, 2022
API Development Increases Access to Shared Computing Resources at Boston University
George Jones, Amanda E Wakefield, Jeff Triplett, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
March 4, 2026
Bias in the AlphaFold3 prediction of ligand-induced domain motion in enzymes
Hao Yu, Ayse A Bekar-Cesaretli, Maria Lazou, et al.
Journal of Chemical Information and Modeling
|
August 22, 2025
Impact of Protein Conformational Diversity on Structure-Based Prediction of Druggability
Ayse A Bekar-Cesaretli, Shray Vats, Adrian Whitty, et al.
Journal of Chemical Information and Modeling
|
January 22, 2024
Conservation of Hot Spots and Ligand Binding Sites in Protein Models by AlphaFold2
Ayse A Bekar-Cesaretli, Omeir Khan, Thu Nguyen, et al.
Proteins
|
August 14, 2009
Structural insights into recognition of beta2-glycoprotein I by the lipoprotein receptors
Dmitri Beglov, Chang-Jin Lee, Alfredo De Biasio, et al.
Proteins
|
September 3, 2013
How good is automated protein docking?
Dima Kozakov, Dmitri Beglov, Tanggis Bohnuud, et al.
Nature Chemical Biology
|
July 21, 2014
How proteins bind macrocycles
Elizabeth A Villar, Dmitri Beglov, Spandan Chennamadhavuni, et al.
Journal of Chemical Theory and Computation
|
October 21, 2014
Efficient Maintenance and Update of Nonbonded Lists in Macromolecular Simulations
Rezaul Chowdhury, Dmitri Beglov, Mohammad Moghadasi, et al.
Page
of 17