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Entries: 1-10  
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What stabilizes the 314-helix in beta3-peptides? A conformational analysis using molecular simulation.
Authors: Keller, B.; Gattin, Z.; van Gunsteren, W. F.
Date of Publication (YYYY-MM-DD): 2010-05-15
Title of Journal: Proteins
Volume: 78
Issue / Number: 7
Start Page: 1677
End Page: 1690
Document Type: Article
ID: 535984.0
A combined solid-state NMR and MD characterization of the stability and dynamics of the HET-s(218-289) prion in its amyloid conformation.
Authors: Lange, A.; Gattin, Z.; Van Melckebeke, H.; Wasmer, C.; Soragni, A.; van Gunsteren, W. F.; Meier, B. H.
Date of Publication (YYYY-MM-DD): 2009-07-06
Title of Journal: ChemBioChem
Volume: 10
Issue / Number: 10
Start Page: 1657
End Page: 1665
Document Type: Article
ID: 433676.0
Analysis of neo-pentane-urea pair potentials of mean force in aqueous urea
Authors: Trzesniak, D.; Van Der Vegt, Nico F. A.; Van Gunsteren, W. F.
Date of Publication (YYYY-MM-DD): 2007
Title of Journal: Molecular Physics
Volume: 105
Issue / Number: 1
Start Page: 33
End Page: 39
Document Type: Article
ID: 313673.0
Enthalpy-entropy compensation in the effects of urea on hydrophobic interactions
Authors: van der Vegt, Nico F. A.; Lee, M. E.; Trzesniak, D.; van Gunsteren, W. F.
Date of Publication (YYYY-MM-DD): 2006
Title of Journal: Journal of Physical Chemistry B
Volume: 110
Issue / Number: 26
Start Page: 12852
End Page: 12855
Document Type: Article
ID: 284824.0
Biomolecular modeling: Goals, problems, perspectives
Authors: van Gunsteren, W. F.; Bakowies, D.; Baron, R.; Chandrasekhar, I.; Christen, M.; Daura, X.; Gee, P.; Geerke, D. P.; Glättli, A.; Hünenberger, P. H.; Kastenholz, M. A.; Ostenbrink, C.; Schenk, M.; Trzesniak, D.; van der Vegt, Nico F. A.; Yu, H. B.
Date of Publication (YYYY-MM-DD): 2006
Title of Journal: Angewandte Chemie-International Edition
Volume: 45
Issue / Number: 25
Start Page: 4064
End Page: 4092
Document Type: Article
ID: 284844.0
Validation of the 53A6 GROMOS force field
Authors: Oostenbrink, C.; Soares, T. A.; van der Vegt, Nico F. A.; van Gunsteren, W. F.
Date of Publication (YYYY-MM-DD): 2005
Title of Journal: European Biophysics Journal with Biophysics Letters
Volume: 34
Issue / Number: 4
Start Page: 273
End Page: 284
Document Type: Article
ID: 236957.0
Entropic contributions in cosolvent binding to hydrophobic solutes in water
Authors: van der Vegt, Nico F. A.; van Gunsteren, W. F.
Date of Publication (YYYY-MM-DD): 2004-01-22
Title of Journal: Journal of Physical Chemistry B
Volume: 108
Issue / Number: 3
Start Page: 1056
End Page: 1064
Document Type: Article
ID: 117150.0
Computer simulation studies on the solvation of aliphatic hydrocarbons in 6.9 M aqueous urea solution
Authors: Trzesniak, D.; van der Vegt, Nico F. A.; van Gunsteren, W. F.
Date of Publication (YYYY-MM-DD): 2004
Title of Journal: Physical Chemistry Chemical Physics
Volume: 6
Issue / Number: 4
Start Page: 697
End Page: 702
Document Type: Article
ID: 117133.0
An effective force field for molecular dynamics simulations of dimethyl sulfoxide and dimethyl sulfoxide-water mixtures
Authors: Geerke, D. P.; Oostenbrink, C.; van der Vegt, Nico F. A.; van Gunsteren, W. F.
Date of Publication (YYYY-MM-DD): 2004
Title of Journal: Journal of Physical Chemistry B
Volume: 108
Issue / Number: 4
Start Page: 1436
End Page: 1445
Document Type: Article
ID: 199034.0
Chemical library subset selection algorithms: A unified derivation using spatial statistics
Authors: Hamprecht, F. A.; Thiel, W.; van Gunsteren, W. F.
Date of Publication (YYYY-MM-DD): 2002-03
Title of Journal: Journal of Chemical Information and Computer Sciences
Volume: 42
Issue / Number: 2
Start Page: 414
End Page: 428
Document Type: Article
ID: 20115.0
Entries: 1-10  
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