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The Journal of Physical Chemistry. B
|
February 9, 2018
Identification of Rare Lewis Oligosaccharide Conformers in Aqueous Solution Using Enhanced Sampling Molecular Dynamics
Irfan Alibay, Kepa K Burusco, Neil J Bruce, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
September 30, 2015
Free Energy Calculations using a Swarm-Enhanced Sampling Molecular Dynamics Approach
Kepa K Burusco, Neil J Bruce, Irfan Alibay, et al.
Magnetic Resonance in Chemistry : MRC
|
June 4, 2014
Configuration and conformation of alfentanil hydrochloride. Conformational study by NMR and theoretical calculations
Carlos Jaime, Albert Virgili, Susana Portillo, et al.
Journal of Chemical Information and Modeling
|
September 5, 2025
Data-Driven Generation of Conformational Ensembles and Ternary Complexes for PROTAC and Other Chimera Systems
Fabio Montisci, Laura Friggeri, Kepa K Burusco-Goni, et al.
Journal of Chemical Information and Modeling
|
September 2, 2014
Exploring protein kinase conformation using swarm-enhanced sampling molecular dynamics
Alessio Atzori, Neil J Bruce, Kepa K Burusco, et al.
Biomaterials
|
October 17, 2016
'Dual' peptidyl-oligonucleotide conjugates: Role of conformational flexibility in catalytic cleavage of RNA
Yaroslav Staroseletz, Aled Williams, Kepa K Burusco, et al.
The Journal of Organic Chemistry
|
October 4, 2012
Secondary structure of short β-peptides as the chiral expression of monomeric building units: a rational and predictive model
Esther Gorrea, Gábor Pohl, Pau Nolis, et al.
The Journal of Organic Chemistry
|
March 24, 2009
Size-tunable trehalose-based nanocavities: synthesis, structure, and inclusion properties of large-ring cyclotrehalans
David Rodríguez-Lucena, Carmen Ortiz Mellet, Carlos Jaime, et al.
Antimicrobial Agents and Chemotherapy
|
January 23, 2020
Lead Optimization of Dehydroemetine for Repositioned Use in Malaria
Priyanka Panwar, Kepa K Burusco, Muna Abubaker, et al.
Nucleic Acids Research
|
October 3, 2020
Strict conformational demands of RNA cleavage in bulge-loops created by peptidyl-oligonucleotide conjugates
Yaroslav Staroseletz, Bahareh Amirloo, Aled Williams, et al.
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Search research articles
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Showing results (1-10 of 13) with videos related to
Sort By:
Page
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The Journal of Physical Chemistry. B
|
February 9, 2018
Identification of Rare Lewis Oligosaccharide Conformers in Aqueous Solution Using Enhanced Sampling Molecular Dynamics
Irfan Alibay, Kepa K Burusco, Neil J Bruce, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
September 30, 2015
Free Energy Calculations using a Swarm-Enhanced Sampling Molecular Dynamics Approach
Kepa K Burusco, Neil J Bruce, Irfan Alibay, et al.
Magnetic Resonance in Chemistry : MRC
|
June 4, 2014
Configuration and conformation of alfentanil hydrochloride. Conformational study by NMR and theoretical calculations
Carlos Jaime, Albert Virgili, Susana Portillo, et al.
Journal of Chemical Information and Modeling
|
September 5, 2025
Data-Driven Generation of Conformational Ensembles and Ternary Complexes for PROTAC and Other Chimera Systems
Fabio Montisci, Laura Friggeri, Kepa K Burusco-Goni, et al.
Journal of Chemical Information and Modeling
|
September 2, 2014
Exploring protein kinase conformation using swarm-enhanced sampling molecular dynamics
Alessio Atzori, Neil J Bruce, Kepa K Burusco, et al.
Biomaterials
|
October 17, 2016
'Dual' peptidyl-oligonucleotide conjugates: Role of conformational flexibility in catalytic cleavage of RNA
Yaroslav Staroseletz, Aled Williams, Kepa K Burusco, et al.
The Journal of Organic Chemistry
|
October 4, 2012
Secondary structure of short β-peptides as the chiral expression of monomeric building units: a rational and predictive model
Esther Gorrea, Gábor Pohl, Pau Nolis, et al.
The Journal of Organic Chemistry
|
March 24, 2009
Size-tunable trehalose-based nanocavities: synthesis, structure, and inclusion properties of large-ring cyclotrehalans
David Rodríguez-Lucena, Carmen Ortiz Mellet, Carlos Jaime, et al.
Antimicrobial Agents and Chemotherapy
|
January 23, 2020
Lead Optimization of Dehydroemetine for Repositioned Use in Malaria
Priyanka Panwar, Kepa K Burusco, Muna Abubaker, et al.
Nucleic Acids Research
|
October 3, 2020
Strict conformational demands of RNA cleavage in bulge-loops created by peptidyl-oligonucleotide conjugates
Yaroslav Staroseletz, Bahareh Amirloo, Aled Williams, et al.
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of 2