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Ken Borrelli

Showing results (1-10 of 5) with videos related to

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Scientific Reports|April 28, 2018
High throughput evaluation of macrocyclization strategies for conformer stabilizationDan Sindhikara, Ken Borrelli
Journal of Chemical Theory and Computation|May 23, 2023
Quantitatively Accounting for Protein Reorganization in Computer-Aided Drug DesignMikolai Fajer, Ken Borrelli, Robert Abel, et al.
Toxins|October 15, 2020
Water Thermodynamics of Peptide Toxin Binding Sites on Ion ChannelsBinita Shah, Dan Sindhikara, Ken Borrelli, et al.
Journal of Chemical Information and Modeling|July 21, 2017
Improving Accuracy, Diversity, and Speed with Prime Macrocycle Conformational SamplingDan Sindhikara, Steven A Spronk, Tyler Day, et al.
Journal of Chemical Theory and Computation|May 5, 2016
Prediction of Protein-Ligand Binding Poses via a Combination of Induced Fit Docking and Metadynamics SimulationsAnthony J Clark, Pratyush Tiwary, Ken Borrelli, et al.
Pageof 1

Showing results (1-10 of 5) with videos related to

Sort By:
Pageof 1
Scientific Reports|April 28, 2018
High throughput evaluation of macrocyclization strategies for conformer stabilizationDan Sindhikara, Ken Borrelli
Journal of Chemical Theory and Computation|May 23, 2023
Quantitatively Accounting for Protein Reorganization in Computer-Aided Drug DesignMikolai Fajer, Ken Borrelli, Robert Abel, et al.
Toxins|October 15, 2020
Water Thermodynamics of Peptide Toxin Binding Sites on Ion ChannelsBinita Shah, Dan Sindhikara, Ken Borrelli, et al.
Journal of Chemical Information and Modeling|July 21, 2017
Improving Accuracy, Diversity, and Speed with Prime Macrocycle Conformational SamplingDan Sindhikara, Steven A Spronk, Tyler Day, et al.
Journal of Chemical Theory and Computation|May 5, 2016
Prediction of Protein-Ligand Binding Poses via a Combination of Induced Fit Docking and Metadynamics SimulationsAnthony J Clark, Pratyush Tiwary, Ken Borrelli, et al.
Pageof 1