[toc] pdb2gmx12gmx pdb2gmx [-f [<.gro/.g96/...>]] [-o [<.gro/.g96/...>]] [-p [<.top>]]gmx pdb2gmx -f xxx.pdb -o xxx.gro -p xxx.top Tags: GROMACS pdb2gmx ← 编译C++程序:Makefile文件 Python奇淫巧计-2 →