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The Journal of Chemical Physics
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May 23, 2012
Spin densities from subsystem density-functional theory: assessment and application to a photosynthetic reaction center complex model
Alisa Solovyeva, Michele Pavanello, Johannes Neugebauer
The Journal of Chemical Physics
|
May 3, 2014
Describing long-range charge-separation processes with subsystem density-functional theory
Alisa Solovyeva, Michele Pavanello, Johannes Neugebauer
Physical Chemistry Chemical Physics : PCCP
|
November 4, 2016
Alchemical screening of ionic crystals
Alisa Solovyeva, O Anatole von Lilienfeld
Drug Discovery Today
|
August 22, 2024
Hit me with your best shot: Integrated hit discovery for the next generation of drug targets
S Neha Ashraf, J Henry Blackwell, Geoffrey A Holdgate, et al.
ACS Medicinal Chemistry Letters
|
August 20, 2025
Discovery of Small-Molecule Ligands for the E3 Ligase STUB1/CHIP from a DNA-Encoded Library Screen
Simon C C Lucas, Alexander G Milbradt, Jason Breed, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 5) with videos related to
Sort By:
Page
of 1
The Journal of Chemical Physics
|
May 23, 2012
Spin densities from subsystem density-functional theory: assessment and application to a photosynthetic reaction center complex model
Alisa Solovyeva, Michele Pavanello, Johannes Neugebauer
The Journal of Chemical Physics
|
May 3, 2014
Describing long-range charge-separation processes with subsystem density-functional theory
Alisa Solovyeva, Michele Pavanello, Johannes Neugebauer
Physical Chemistry Chemical Physics : PCCP
|
November 4, 2016
Alchemical screening of ionic crystals
Alisa Solovyeva, O Anatole von Lilienfeld
Drug Discovery Today
|
August 22, 2024
Hit me with your best shot: Integrated hit discovery for the next generation of drug targets
S Neha Ashraf, J Henry Blackwell, Geoffrey A Holdgate, et al.
ACS Medicinal Chemistry Letters
|
August 20, 2025
Discovery of Small-Molecule Ligands for the E3 Ligase STUB1/CHIP from a DNA-Encoded Library Screen
Simon C C Lucas, Alexander G Milbradt, Jason Breed, et al.
Page
of 1