Literature DB >> 3075759

The role of computer simulation techniques in protein engineering.

W F van Gunsteren1.   

Abstract

Mesh：

Year:  1988        PMID： 3075759     DOI： 10.1093/protein/2.1.5

Source DB:  PubMed          Journal:  Protein Eng        ISSN： 0269-2139


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  11 in total

1.  An algorithm for protein engineering: simulations of recursive ensemble mutagenesis.

Authors:  A P Arkin; D C Youvan
Journal:  Proc Natl Acad Sci U S A       Date:  1992-08-15       Impact factor: 11.205

2.  Construction of interleukin-1 alpha mutants using unequal contamination of synthetic oligonucleotides.

Authors:  K Poindexter; R Jerzy; R B Gayle
Journal:  Nucleic Acids Res       Date:  1991-04-25       Impact factor: 16.971

3.  Modelling of peptide and protein structures.

Authors:  S Fraga; J M Parker
Journal:  Amino Acids       Date:  1994-06       Impact factor: 3.520

Review 4.  Boltzmann's principle, knowledge-based mean fields and protein folding. An approach to the computational determination of protein structures.

Authors:  M J Sippl
Journal:  J Comput Aided Mol Des       Date:  1993-08       Impact factor: 3.686

Review 5.  Prediction and analysis of structure, stability and unfolding of thermolysin-like proteases.

Authors:  G Vriend; V Eijsink
Journal:  J Comput Aided Mol Des       Date:  1993-08       Impact factor: 3.686

6.  Calculation of solvation and binding free energy differences between VX-478 and its analogs by free energy perturbation and AMSOL methods.

Authors:  B G Rao; E E Kim; M A Murcko
Journal:  J Comput Aided Mol Des       Date:  1996-02       Impact factor: 3.686

7.  Computer-aided drug design: a free energy perturbation study on the binding of methyl-substituted pterins and N5-deazapterins to dihydrofolate reductase.

Authors:  P L Cummins; J E Gready
Journal:  J Comput Aided Mol Des       Date:  1993-10       Impact factor: 3.686

8.  The dynamic properties of melittin in solution. Investigations by NMR and molecular dynamics.

Authors:  A Pastore; T S Harvey; C E Dempsey; I D Campbell
Journal:  Eur Biophys J       Date:  1989       Impact factor: 1.733

9.  The application of three approximate free energy calculations methods to structure based ligand design: trypsin and its complex with inhibitors.

Authors:  R J Radmer; P A Kollman
Journal:  J Comput Aided Mol Des       Date:  1998-05       Impact factor: 3.686

10.  Computational prediction of alanine scanning and ligand binding energetics in G-protein coupled receptors.

Authors:  Lars Boukharta; Hugo Gutiérrez-de-Terán; Johan Aqvist
Journal:  PLoS Comput Biol       Date:  2014-04-17       Impact factor: 4.475
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