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Pedro A Valiente

Showing results (11-20 of 47) with videos related to

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Proteins|August 31, 2020
Exploring the conformational dynamics of PD1 in complex with different ligands: What we can learn for designing novel PD1 signaling blockers?Luis F Ponce, Karina García-Martínez, Kalet León, et al.
The Journal of Physical Chemistry. B|July 23, 2016
Improved QM/MM Linear-Interaction Energy Model for Substrate Recognition in Zinc-Containing MetalloenzymesWilliams E Miranda, Van A Ngo, Pedro A Valiente, et al.
Journal of Structural Biology|June 23, 2016
Structures of a bi-functional Kunitz-type STI family inhibitor of serine and aspartic proteases: Could the aspartic protease inhibition have evolved from a canonical serine protease-binding loop?Yasel Guerra, Pedro A Valiente, Tirso Pons, et al.
Journal of Chemical Information and Modeling|July 25, 2022
Targeting the Receptor-Binding Motif of SARS-CoV-2 with D-Peptides Mimicking the ACE2 Binding Helix: Lessons for Inhibiting Omicron and Future Variants of ConcernPedro A Valiente, Satra Nim, JinAh Lee, et al.
The Journal of Physical Chemistry. B|June 21, 2023
Predicting a Stable Dimeric Form of the PD1-PDL1 Complex: Implications for Understanding the PD1 Activation MechanismLuis F Ponce, Daniel P Ramírez-Echemendia, Kalet León, et al.
Proteins|May 26, 2017
Predicting binding modes of reversible peptide-based inhibitors of falcipain-2 consistent with structure-activity relationshipsJorge Enrique Hernández González, Lilian Hernández Alvarez, Pedro Geraldo Pascutti, et al.
The Journal of Physical Chemistry. B|January 20, 2023
Assessment of Different Parameters on the Accuracy of Computational Alanine Scanning of Protein-Protein Complexes with the Molecular Mechanics/Generalized Born Surface Area MethodMario E Valdés-Tresanco, Mario S Valdés-Tresanco, Ernesto Moreno, et al.
Journal of Chemical Information and Modeling|August 27, 2024
Antibody-SGM, a Score-Based Generative Model for Antibody Heavy-Chain DesignXuezhi Xie, Pedro A Valiente, Jin Sub Lee, et al.
Journal of Chemical Theory and Computation|September 29, 2021
gmx_MMPBSA: A New Tool to Perform End-State Free Energy Calculations with GROMACSMario S Valdés-Tresanco, Mario E Valdés-Tresanco, Pedro A Valiente, et al.
Biology Direct|September 17, 2020
AMDock: a versatile graphical tool for assisting molecular docking with Autodock Vina and Autodock4Mario S Valdés-Tresanco, Mario E Valdés-Tresanco, Pedro A Valiente, et al.
Pageof 5

Showing results (11-20 of 47) with videos related to

Sort By:
Pageof 5
Proteins|August 31, 2020
Exploring the conformational dynamics of PD1 in complex with different ligands: What we can learn for designing novel PD1 signaling blockers?Luis F Ponce, Karina García-Martínez, Kalet León, et al.
The Journal of Physical Chemistry. B|July 23, 2016
Improved QM/MM Linear-Interaction Energy Model for Substrate Recognition in Zinc-Containing MetalloenzymesWilliams E Miranda, Van A Ngo, Pedro A Valiente, et al.
Journal of Structural Biology|June 23, 2016
Structures of a bi-functional Kunitz-type STI family inhibitor of serine and aspartic proteases: Could the aspartic protease inhibition have evolved from a canonical serine protease-binding loop?Yasel Guerra, Pedro A Valiente, Tirso Pons, et al.
Journal of Chemical Information and Modeling|July 25, 2022
Targeting the Receptor-Binding Motif of SARS-CoV-2 with D-Peptides Mimicking the ACE2 Binding Helix: Lessons for Inhibiting Omicron and Future Variants of ConcernPedro A Valiente, Satra Nim, JinAh Lee, et al.
The Journal of Physical Chemistry. B|June 21, 2023
Predicting a Stable Dimeric Form of the PD1-PDL1 Complex: Implications for Understanding the PD1 Activation MechanismLuis F Ponce, Daniel P Ramírez-Echemendia, Kalet León, et al.
Proteins|May 26, 2017
Predicting binding modes of reversible peptide-based inhibitors of falcipain-2 consistent with structure-activity relationshipsJorge Enrique Hernández González, Lilian Hernández Alvarez, Pedro Geraldo Pascutti, et al.
The Journal of Physical Chemistry. B|January 20, 2023
Assessment of Different Parameters on the Accuracy of Computational Alanine Scanning of Protein-Protein Complexes with the Molecular Mechanics/Generalized Born Surface Area MethodMario E Valdés-Tresanco, Mario S Valdés-Tresanco, Ernesto Moreno, et al.
Journal of Chemical Information and Modeling|August 27, 2024
Antibody-SGM, a Score-Based Generative Model for Antibody Heavy-Chain DesignXuezhi Xie, Pedro A Valiente, Jin Sub Lee, et al.
Journal of Chemical Theory and Computation|September 29, 2021
gmx_MMPBSA: A New Tool to Perform End-State Free Energy Calculations with GROMACSMario S Valdés-Tresanco, Mario E Valdés-Tresanco, Pedro A Valiente, et al.
Biology Direct|September 17, 2020
AMDock: a versatile graphical tool for assisting molecular docking with Autodock Vina and Autodock4Mario S Valdés-Tresanco, Mario E Valdés-Tresanco, Pedro A Valiente, et al.
Pageof 5