MBAR program
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********************************************************************** MBAR Copyright (C) 2013 Simone Marsili and Piero Procacci ********************************************************************** Multiple Bennett Acceptance ratio (MBAR) algorithm with BAR estimate for contiguous replicas. See COPYING for terms and conditions of use and distribution of the program. ********************************************************************** The program is provided (for unix platforms alone) as a compressed tar archive [mbar.tar.gz]. Download the file mbar.tar.gz and uncompress with $ tar -zxvf mbar.tar.gz A "SI_bar" directory is created containing this README a COPYING file and two sub-directories: src -> source directory with the MBAR program examples -> directory containing a simple test. to compile the program cd into "src" dir and do $ make to run the tests cd into the "examples" dir and do $ ./BAR.bash For more info see the README files inside "src" and "examples"
MBAR 版权所有 (C) 2013 Simone Marsili 与 Piero Procacci ********************************************************************** 多重贝内特接受比(Multiple Bennett Acceptance Ratio,MBAR)算法,其采用针对连续副本的贝内特接受比(Bennett Acceptance Ratio,BAR)估计方法。请参阅COPYING文件以了解本程序的使用与分发条款与条件。 ********************************************************************** 本程序(仅适用于Unix平台)以压缩tar归档文件[mbar.tar.gz]形式提供。请下载文件mbar.tar.gz并通过命令 $ tar -zxvf mbar.tar.gz 进行解压。 解压后将创建名为"SI_bar"的目录,其中包含本README文件、COPYING文件以及两个子目录:"src"——存放MBAR程序源代码的目录;"examples"——包含简易测试用例的目录。 编译程序时,请进入"src"目录并执行以下命令:$ make 运行测试用例时,请进入"examples"目录并执行以下命令:$ ./BAR.bash 如需获取更多信息,请参阅"src"与"examples"目录内的README文件。




