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Anders Wallqvist

Showing results (1-10 of 180) with videos related to

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Journal of Chemical Information and Modeling|February 6, 2014
Merging applicability domains for in silico assessment of chemical mutagenicityRuifeng Liu, Anders Wallqvist
Journal of Chemical Information and Modeling|November 9, 2018
Molecular Similarity-Based Domain Applicability Metric Efficiently Identifies Out-of-Domain CompoundsRuifeng Liu, Anders Wallqvist
Journal of Chemical Theory and Computation|December 15, 2010
Computing Relative Free Energies of Solvation using Single Reference Thermodynamic Integration Augmented with Hamiltonian Replica ExchangeIlja V Khavrutskii, Anders Wallqvist
The Journal of Physical Chemistry. B|June 10, 2011
Spontaneous buckling of lipid bilayer and vesicle budding induced by antimicrobial peptide magainin 2: a coarse-grained simulation studyHyung-June Woo, Anders Wallqvist
The Journal of Physical Chemistry. B|August 19, 2009
Structure and dynamics of end-to-end loop formation of the penta-peptide Cys-Ala-Gly-Gln-Trp in implicit solventsIn-Chul Yeh, Anders Wallqvist
Journal of Chemical Theory and Computation|November 3, 2011
Improved Binding Free Energy Predictions from Single-Reference Thermodynamic Integration Augmented with Hamiltonian Replica ExchangeIlja V Khavrutskii, Anders Wallqvist
The Journal of Chemical Physics|February 10, 2011
On the proper calculation of electrostatic interactions in solid-supported bilayer systemsIn-Chul Yeh, Anders Wallqvist
International Journal of Molecular Sciences|December 23, 2023
High-Throughput Transcriptomics Differentiates Toxic versus Non-Toxic Chemical Exposures Using a Rat Liver ModelVenkat R Pannala, Anders Wallqvist
Physical Review Letters|March 17, 2011
Nonequilibrium phase transitions associated with DNA replicationHyung-June Woo, Anders Wallqvist
ACS Omega|July 20, 2018
Using the Variable-Nearest Neighbor Method To Identify P-Glycoprotein Substrates and InhibitorsPatric Schyman, Ruifeng Liu, Anders Wallqvist
Pageof 18

Showing results (1-10 of 180) with videos related to

Sort By:
Pageof 18
Journal of Chemical Information and Modeling|February 6, 2014
Merging applicability domains for in silico assessment of chemical mutagenicityRuifeng Liu, Anders Wallqvist
Journal of Chemical Information and Modeling|November 9, 2018
Molecular Similarity-Based Domain Applicability Metric Efficiently Identifies Out-of-Domain CompoundsRuifeng Liu, Anders Wallqvist
Journal of Chemical Theory and Computation|December 15, 2010
Computing Relative Free Energies of Solvation using Single Reference Thermodynamic Integration Augmented with Hamiltonian Replica ExchangeIlja V Khavrutskii, Anders Wallqvist
The Journal of Physical Chemistry. B|June 10, 2011
Spontaneous buckling of lipid bilayer and vesicle budding induced by antimicrobial peptide magainin 2: a coarse-grained simulation studyHyung-June Woo, Anders Wallqvist
The Journal of Physical Chemistry. B|August 19, 2009
Structure and dynamics of end-to-end loop formation of the penta-peptide Cys-Ala-Gly-Gln-Trp in implicit solventsIn-Chul Yeh, Anders Wallqvist
Journal of Chemical Theory and Computation|November 3, 2011
Improved Binding Free Energy Predictions from Single-Reference Thermodynamic Integration Augmented with Hamiltonian Replica ExchangeIlja V Khavrutskii, Anders Wallqvist
The Journal of Chemical Physics|February 10, 2011
On the proper calculation of electrostatic interactions in solid-supported bilayer systemsIn-Chul Yeh, Anders Wallqvist
International Journal of Molecular Sciences|December 23, 2023
High-Throughput Transcriptomics Differentiates Toxic versus Non-Toxic Chemical Exposures Using a Rat Liver ModelVenkat R Pannala, Anders Wallqvist
Physical Review Letters|March 17, 2011
Nonequilibrium phase transitions associated with DNA replicationHyung-June Woo, Anders Wallqvist
ACS Omega|July 20, 2018
Using the Variable-Nearest Neighbor Method To Identify P-Glycoprotein Substrates and InhibitorsPatric Schyman, Ruifeng Liu, Anders Wallqvist
Pageof 18