BioSimGrid: towards a worldwide repository for biomolecular simulations.
暂无分享,去创建一个
Stuart Murdock | Kaihsu Tai | Muan Hong Ng | Steven J. Johnston | Bing Wu | Hans Fangohr | Jonathan W Essex | Simon J Cox | J. Essex | K. Tai | P. Jeffreys | S. Cox | H. Fangohr | M. Sansom | S. Murdock | Bing Wu | Mark S P Sansom | Paul Jeffreys | Steven Johnston
[1] Laxmikant V. Kale,et al. NAMD2: Greater Scalability for Parallel Molecular Dynamics , 1999 .
[2] Matin Abdullah,et al. SimDB - A Grid Software Environment for Molecular Dynamics Simulation and Analysis: Design and User Interface , 2002 .
[3] C. Brooks. Computer simulation of liquids , 1989 .
[4] Guido van Rossum,et al. An Introduction to Python , 2003 .
[5] K Schulten,et al. VMD: visual molecular dynamics. , 1996, Journal of molecular graphics.
[6] U. Hansmann. Parallel tempering algorithm for conformational studies of biological molecules , 1997, physics/9710041.
[7] T. N. Bhat,et al. The Protein Data Bank , 2000, Nucleic Acids Res..
[8] Marc Baaden,et al. A molecular dynamics investigation of mono and dimeric states of the outer membrane enzyme OMPLA. , 2003, Journal of molecular biology.
[9] Stéphane Bressan,et al. Introduction to Database Systems , 2005 .
[10] Richard H. Henchman,et al. Mechanism of acetylcholinesterase inhibition by fasciculin: a 5-ns molecular dynamics simulation. , 2002, Journal of the American Chemical Society.
[11] J Andrew McCammon,et al. Structural and dynamic properties of water around acetylcholinesterase , 2002, Protein science : a publication of the Protein Society.
[12] J. Banavar,et al. Computer Simulation of Liquids , 1988 .
[13] Reversible Digitally Filtered Molecular Dynamics , 2003 .
[14] Alan E Mark,et al. Relative stability of protein structures determined by X‐ray crystallography or NMR spectroscopy: A molecular dynamics simulation study , 2003, Proteins.
[15] Jonathan W. Essex,et al. BioSimGrid: a distributed database for biomolecular simulations , 2003 .
[16] Peter A. Kollman,et al. AMBER, a package of computer programs for applying molecular mechanics, normal mode analysis, molecular dynamics and free energy calculations to simulate the structural and energetic properties of molecules , 1995 .
[17] Andrew Pang,et al. Interdomain dynamics and ligand binding: molecular dynamics simulations of glutamine binding protein , 2003, FEBS letters.
[18] John D. Westbrook,et al. The PDB Format, mmCIF Formats, and Other Data Formats , 2005 .