rosetta运行求助Executable = workdavisligand_docklinuxiccreleaseUniverse = vanillaInitialdir = workdavisprojectsjnk_samplArguments = FLAGStxt -infiles inputjnk_pp_1_001pdb -outpathpdb workjnk_pp_1_001$Proc
在普通的终端命令行中,可以将Executable和Initialdir改为本地文件路径,如:
Executable = /home/user/ligand_dock.linuxiccrelease Initialdir = /home/user/projects/jnk_sampl
Arguments = @FLAGS.txt -in:file:s input/jnk_pp_1_001.pdb -out:path:pdb /home/user/projects/jnk_sampl/work/jnk_pp_1_001/$(Process) -run:seed_offset $(Process) -out:suffix _$(Process) Queue 10
需要注意的是,本地文件路径需要根据实际情况进行修改。另外,如果在本地终端命令行中运行,需要安装和配置相应的软件和环境。
原文地址: https://www.cveoy.top/t/topic/e9jP 著作权归作者所有。请勿转载和采集!