Literature DB >> 15663001

BODIL: a molecular modeling environment for structure-function analysis and drug design.

Jukka V Lehtonen1, Dan-Johan Still, Ville-V Rantanen, Jan Ekholm, Dag Björklund, Zuhair Iftikhar, Mikko Huhtala, Susanna Repo, Antti Jussila, Jussi Jaakkola, Olli Pentikäinen, Tommi Nyrönen, Tiina Salminen, Mats Gyllenberg, Mark S Johnson.   

Abstract

BODIL is a molecular modeling environment geared to help the user to quickly identify key features of proteins critical to molecular recognition, especially (1) in drug discovery applications, and (2) to understand the structural basis for function. The program incorporates state-of-the-art graphics, sequence and structural alignment methods, among other capabilities needed in modern structure-function-drug target research. BODIL has a flexible design that allows on-the-fly incorporation of new modules, has intelligent memory management, and fast multi-view graphics. A beta version of BODIL and an accompanying tutorial are available at http://www.abo.fi/fak/mnf/bkf/research/johnson/bodil.html.

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Year:  2004        PMID: 15663001     DOI: 10.1007/s10822-004-3752-4

Source DB:  PubMed          Journal:  J Comput Aided Mol Des        ISSN: 0920-654X            Impact factor:   3.686


  21 in total

1.  The Protein Data Bank.

Authors:  H M Berman; J Westbrook; Z Feng; G Gilliland; T N Bhat; H Weissig; I N Shindyalov; P E Bourne
Journal:  Nucleic Acids Res       Date:  2000-01-01       Impact factor: 16.971

2.  The penultimate rotamer library.

Authors:  S C Lovell; J M Word; J S Richardson; D C Richardson
Journal:  Proteins       Date:  2000-08-15

3.  A Bayesian molecular interaction library.

Authors:  Ville-Veikko Rantanen; Mats Gyllenberg; Timo Koski; Mark S Johnson
Journal:  J Comput Aided Mol Des       Date:  2003-07       Impact factor: 3.686

4.  A dissimilarity matrix between protein atom classes based on Gaussian mixtures.

Authors:  Ville-Veikko Rantanen; Mats Gyllenberg; Timo Koski; Mark S Johnson
Journal:  Bioinformatics       Date:  2002-09       Impact factor: 6.937

5.  Exploring structural homology of proteins.

Authors:  M G Rossmann; P Argos
Journal:  J Mol Biol       Date:  1976-07-25       Impact factor: 5.469

6.  Improved tools for biological sequence comparison.

Authors:  W R Pearson; D J Lipman
Journal:  Proc Natl Acad Sci U S A       Date:  1988-04       Impact factor: 11.205

7.  A structural basis for sequence comparisons. An evaluation of scoring methodologies.

Authors:  M S Johnson; J P Overington
Journal:  J Mol Biol       Date:  1993-10-20       Impact factor: 5.469

8.  Solvent-accessible surfaces of proteins and nucleic acids.

Authors:  M L Connolly
Journal:  Science       Date:  1983-08-19       Impact factor: 47.728

9.  Structural and functional analysis of integrin alpha2I domain interaction with echovirus 1.

Authors:  Li Xing; Mikko Huhtala; Vilja Pietiäinen; Jarmo Käpylä; Kirsi Vuorinen; Varpu Marjomäki; Jyrki Heino; Mark S Johnson; Timo Hyypiä; R Holland Cheng
Journal:  J Biol Chem       Date:  2003-12-29       Impact factor: 5.157

10.  The structure of bovine lysosomal alpha-mannosidase suggests a novel mechanism for low-pH activation.

Authors:  Pirkko Heikinheimo; Ronny Helland; Hanna-Kirsti Schrøder Leiros; Ingar Leiros; Solveig Karlsen; Gry Evjen; Raimond Ravelli; Guy Schoehn; Rob Ruigrok; Ole Kristian Tollersrud; Seán McSweeney; Edward Hough
Journal:  J Mol Biol       Date:  2003-03-28       Impact factor: 5.469

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  92 in total

1.  Deconstructing honeybee vitellogenin: novel 40 kDa fragment assigned to its N terminus.

Authors:  Heli Havukainen; Øyvind Halskau; Lars Skjaerven; Bente Smedal; Gro V Amdam
Journal:  J Exp Biol       Date:  2011-02-15       Impact factor: 3.312

2.  Cystic fibrosis transmembrane conductance regulator interacts with multiple immunoglobulin domains of filamin A.

Authors:  Martin P Playford; Elisa Nurminen; Olli T Pentikäinen; Sharon L Milgram; John H Hartwig; Thomas P Stossel; Fumihiko Nakamura
Journal:  J Biol Chem       Date:  2010-03-29       Impact factor: 5.157

3.  Ultrafast protein structure-based virtual screening with Panther.

Authors:  Sanna P Niinivehmas; Kari Salokas; Sakari Lätti; Hannu Raunio; Olli T Pentikäinen
Journal:  J Comput Aided Mol Des       Date:  2015-09-25       Impact factor: 3.686

4.  Transcriptional profiles and structural models of the Synechocystis sp. PCC 6803 Deg proteases.

Authors:  Tove Jansén; Heidi Kidron; Hanna Taipaleenmäki; Tiina Salminen; Pirkko Mäenpää
Journal:  Photosynth Res       Date:  2005-06       Impact factor: 3.573

5.  Characterization of single and double inactivation strains reveals new physiological roles for group 2 sigma factors in the cyanobacterium Synechocystis sp. PCC 6803.

Authors:  Maija Pollari; Liisa Gunnelius; Ilona Tuominen; Virpi Ruotsalainen; Esa Tyystjärvi; Tiina Salminen; Taina Tyystjärvi
Journal:  Plant Physiol       Date:  2008-06-06       Impact factor: 8.340

6.  Heterotrimerization of heat-shock factors 1 and 2 provides a transcriptional switch in response to distinct stimuli.

Authors:  Anton Sandqvist; Johanna K Björk; Malin Akerfelt; Zhanna Chitikova; Alexei Grichine; Claire Vourc'h; Caroline Jolly; Tiina A Salminen; Yvonne Nymalm; Lea Sistonen
Journal:  Mol Biol Cell       Date:  2009-01-07       Impact factor: 4.138

7.  Structural comparison of the active site channels in rodent and primate vascular adhesion protein-1.

Authors:  Eva Bligt-Lindén; Ramaiah Arunachalam; Vimal Parkash; Tiina Annamaria Salminen
Journal:  J Neural Transm (Vienna)       Date:  2013-01-18       Impact factor: 3.575

8.  Full domain closure of the ligand-binding core of the ionotropic glutamate receptor iGluR5 induced by the high affinity agonist dysiherbaine and the functional antagonist 8,9-dideoxyneodysiherbaine.

Authors:  Karla Frydenvang; L Leanne Lash; Peter Naur; Pekka A Postila; Darryl S Pickering; Caleb M Smith; Michael Gajhede; Makoto Sasaki; Ryuichi Sakai; Olli T Pentikaïnen; Geoffrey T Swanson; Jette S Kastrup
Journal:  J Biol Chem       Date:  2009-03-18       Impact factor: 5.157

9.  Pharmacological activity of C10-substituted analogs of the high-affinity kainate receptor agonist dysiherbaine.

Authors:  L Leanne Lash-Van Wyhe; Pekka A Postila; Koichi Tsubone; Makoto Sasaki; Olli T Pentikäinen; Ryuichi Sakai; Geoffrey T Swanson
Journal:  Neuropharmacology       Date:  2009-12-04       Impact factor: 5.250

10.  Critical Structural Defects Explain Filamin A Mutations Causing Mitral Valve Dysplasia.

Authors:  Tatu J K Haataja; Romain Capoulade; Simon Lecointe; Maarit Hellman; Jean Merot; Perttu Permi; Ulla Pentikäinen
Journal:  Biophys J       Date:  2019-08-31       Impact factor: 4.033

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