Xavier Daura - Concepedia

Author

Xavier Daura

Universitat Autònoma de Barcelona ORCID

Also Known As

X. Daura, XAVIER DAURA, Xavier Daura

174

Publications

11.4K

Citations

H-Index

105

Concepts

All Affiliations

Universitat Autònoma de Barcelona Institució Catalana de Recerca i Estudis Avançats ETH Zurich Biomedical Research Networking Center in Bioengineering, Biomaterials and Nanomedicine École Polytechnique Fédérale de Lausanne

About

Xavier Daura is an author at Universitat Autònoma de Barcelona specializing in medicine, biophysics, and natural sciences.

Top Concepts

#	Concept	H-Index	Publications	Citations
1	Medicine	24	37	4.2K
2	Natural Sciences	22	27	2.9K
3	Engineering	18	24	4.3K
4	Applied Physics	5	5	1.6K
5	Health Sciences	2	2	60

Xavier Daura

Publications

10.1K

Citations

H-Index

Page 1

	Year	Citations
Peptide Folding: When Simulation Meets Experiment Xavier Daura, Karl Gademann, Bernhard Jaun, Angewandte Chemie International Edition EngineeringNmr SpectroscopyPeptide EngineeringMolecular BiologyMolecular Dynamics	1999	1.9K
AGGRESCAN: a server for the prediction and evaluation of "hot spots" of aggregation in polypeptides Oscar Conchillo‐Solé, Natalia Sánchez de Groot, Francesc Avilés, BMC Bioinformatics	2007	1.1K
An improved GROMOS96 force field for aliphatic hydrocarbons in the condensed phase Lukas D. Schuler, Xavier Daura, Wilfred F. van Gunsteren Journal of Computational Chemistry Free EnergyEngineeringComputational ChemistryChemistryLiquid Densities	2001	886
Parametrization of aliphatic CHn united atoms of GROMOS96 force field Xavier Daura, Alan E. Mark, Wilfred F. van Gunsteren Journal of Computational Chemistry Molecular SolidEngineeringPhysicsTheoretical Inorganic ChemistryNatural Sciences	1998	408
Folding-unfolding thermodynamics of a ?-heptapeptide from equilibrium simulations Xavier Daura, Wilfred F. van Gunsteren, Alan E. Mark Proteins Structure Function and Bioinformatics	1999	390
Reversible peptide folding in solution by molecular dynamics simulation 1 1Edited by R. Huber Xavier Daura, Bernhard Jaun, Dieter Seebàch, Journal of Molecular Biology Protein FoldingPeptide EngineeringReversible Peptide FoldingMolecular BiologyR. Huber	1998	372
Derivation of an improved simple point charge model for liquid water: SPC/A and SPC/L Alice Glättli, Xavier Daura, Wilfred F. van Gunsteren The Journal of Chemical Physics HydrogeologyDifferent ApproachesEngineeringSimple LiquidPhysics	2002	230
Τhe β-Peptide Hairpin in Solution: Conformational Study of a β-Hexapeptide in Methanol by NMR Spectroscopy and MD Simulation Xavier Daura, Karl Gademann, Heiko Schäfer, Journal of the American Chemical Society	2001	199
Can One Derive the Conformational Preference of a β-Peptide from Its CD Spectrum? Alice Glättli, Xavier Daura, Dieter Seebàch, Journal of the American Chemical Society	2002	168
Assessing equilibration and convergence in biomolecular simulations Lorna J. Smith, Xavier Daura, Wilfred F. van Gunsteren Proteins Structure Function and Bioinformatics	2002	148

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