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# http://www.gnu.org/software/gengetopt/gengetopt.html |
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package "Hydro" |
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version "1.0" |
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purpose |
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" |
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+----------------------------------------------------------------------+ |
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| ____ ____ ____ _____ ______ The OpenSource, Object-oriented | |
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| / __ \\/ __ \\/ __ \\/ ___// ____/ Parallel Simulation Engine. | |
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| / / / / / / / /_/ /\\__ \\/ __/ | |
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| / /_/ / /_/ / ____/___/ / /___ Copyright 2004-2006 by the | |
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| \\____/\\____/_/ /____/_____/ University of Notre Dame. | |
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| | |
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| http://www.oopse.org | |
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| | |
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| OOPSE is an OpenScience project. All source code is available for | |
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| any use subject to only one condition: | |
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| | |
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| Any published work resulting from the use of this code must cite the | |
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| following paper: M. A. Meineke, C. F. Vardeman II, T. Lin, | |
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| C. J. Fennell, and J. D. Gezelter, | |
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| J. Comput. Chem. 26, pp. 252-271 (2005). | |
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+----------------------------------------------------------------------+" |
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# Options |
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option "input" i "input dump file" string typestr="filename" yes |
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option "output" o "output file prefix" string default="hydro" no |
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option "viscosity" - "viscosity of solvent" double yes |
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option "sigma" - "diameter of beads(use with rough shell model)" double no |
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option "model" - "hydrodynamics model (support RoughShell and BeadModel)" string yes |
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option "beads" b "generate the beads only, hydrodynamics will be performed" flag off |