Franca Fraternali
www.kcl.ac.uk
0000-0002-3143-6574
King's College London
134 papers found
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An Efficient Mean Solvation Force Model for Use in Molecular Dynamics Simulations of Proteins in Aqueous Solution
Conformational analysis of dolastatin 10: An nmr and theoretical approach
Conformational transitions of a dipeptide in water: Effects of imposed pathways using umbrella sampling techniques
Conformational studies on peptide fragments related to ocytocin and somatostatin precursors.
Computation of free energy in practice: choice of approximations and accuracy limiting factors.
Cation binding to heterodetic peptidic systems: CD and NMR structural studies
Conformational analysis of peptides from Cαα-symmetrically disubstituted aromatic α-amino acid residues
A microscopic approach to the structure and thermodynamic properties of peptides and proteins
Linear oligopeptides 223. Structural versatility of peptides from $C^α,α$-disubstituted glycines. Preferred conformation of the $C^α,α$-diphenylglycine residue.
Sensitivity of peptide conformation to methods and geometrical parameters. A comparative \textitab initio and molecular mechanics study of oligomers of $α$-aminoisobutyric acid.
Restrained and unrestrained molecular dynamics simulations in the NVT ensemble of alamethicin
Structural versatility of peptides containing Cα,α-dialkylated glycines: conformational energy computations, i.r. absorption and 1H n.m.r. analysis of 1-aminocyclopropane-1-carboxylic acid homopeptides
Structural versatility of peptides containing Cα,α-dialkylated glycines. An X-ray diffraction study of six 1-aminocyclopropane-1-carboxylic acid rich peptides
Conformational behavior of $C^α,α$-dialkylated peptides: \textitab initio and empirical results for cyclopropylglycine
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