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Journal of Chemical Theory and Computation
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December 1, 2015
Ligand Entropy in Gas-Phase, Upon Solvation and Protein Complexation. Fast Estimation with Quasi-Newton Hessian
S Wlodek, A G Skillman, A Nicholls
Acta Crystallographica. Section D, Biological Crystallography
|
June 23, 2006
Automated ligand placement and refinement with a combined force field and shape potential
S Wlodek, A G Skillman, A Nicholls
Proteins
|
February 19, 1999
A rapid method for exploring the protein structure universe
M M Young, A G Skillman, I D Kuntz
Journal of Computer-Aided Molecular Design
|
January 8, 1999
CombiDOCK: structure-based combinatorial docking and library design
Y Sun, T J Ewing, A G Skillman, et al.
Journal of Computer-Aided Molecular Design
|
June 8, 2001
DOCK 4.0: search strategies for automated molecular docking of flexible molecule databases
T J Ewing, S Makino, A G Skillman, et al.
Journal of Molecular Graphics & Modelling
|
January 6, 2001
Development and screening of a polyketide virtual library for drug leads against a motilide pharmacophore
M A Siani, A G Skillman, C W Carreras, et al.
Chemistry & Biology
|
April 1, 1997
Structure-based design and combinatorial chemistry yield low nanomolar inhibitors of cathepsin D
E K Kick, D C Roe, A G Skillman, et al.
Proteins
|
January 11, 2001
Design, docking, and evaluation of multiple libraries against multiple targets
M L Lamb, K W Burdick, S Toba, et al.
Journal of Neurochemistry
|
March 29, 2000
Novel cathepsin D inhibitors block the formation of hyperphosphorylated tau fragments in hippocampus
X Bi, T S Haque, J Zhou, et al.
Journal of Medicinal Chemistry
|
April 23, 1999
Potent, low-molecular-weight non-peptide inhibitors of malarial aspartyl protease plasmepsin II
T S Haque, A G Skillman, C E Lee, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 11) with videos related to
Sort By:
Page
of 2
Journal of Chemical Theory and Computation
|
December 1, 2015
Ligand Entropy in Gas-Phase, Upon Solvation and Protein Complexation. Fast Estimation with Quasi-Newton Hessian
S Wlodek, A G Skillman, A Nicholls
Acta Crystallographica. Section D, Biological Crystallography
|
June 23, 2006
Automated ligand placement and refinement with a combined force field and shape potential
S Wlodek, A G Skillman, A Nicholls
Proteins
|
February 19, 1999
A rapid method for exploring the protein structure universe
M M Young, A G Skillman, I D Kuntz
Journal of Computer-Aided Molecular Design
|
January 8, 1999
CombiDOCK: structure-based combinatorial docking and library design
Y Sun, T J Ewing, A G Skillman, et al.
Journal of Computer-Aided Molecular Design
|
June 8, 2001
DOCK 4.0: search strategies for automated molecular docking of flexible molecule databases
T J Ewing, S Makino, A G Skillman, et al.
Journal of Molecular Graphics & Modelling
|
January 6, 2001
Development and screening of a polyketide virtual library for drug leads against a motilide pharmacophore
M A Siani, A G Skillman, C W Carreras, et al.
Chemistry & Biology
|
April 1, 1997
Structure-based design and combinatorial chemistry yield low nanomolar inhibitors of cathepsin D
E K Kick, D C Roe, A G Skillman, et al.
Proteins
|
January 11, 2001
Design, docking, and evaluation of multiple libraries against multiple targets
M L Lamb, K W Burdick, S Toba, et al.
Journal of Neurochemistry
|
March 29, 2000
Novel cathepsin D inhibitors block the formation of hyperphosphorylated tau fragments in hippocampus
X Bi, T S Haque, J Zhou, et al.
Journal of Medicinal Chemistry
|
April 23, 1999
Potent, low-molecular-weight non-peptide inhibitors of malarial aspartyl protease plasmepsin II
T S Haque, A G Skillman, C E Lee, et al.
Page
of 2