ATOM 1149 N MET B
ATOM 1150 CA MET B
ATOM 1151 C MET B
ATOM 1152 O MET B
ATOM 1153 CB MET B
ATOM 1154 CG MET B
ATOM 1155 SD MET B
ATOM 1156 CE MET B
ATOM 1157 N SER B
ATOM 1158 CA SER B
1
1
1
1
1
1
1
1
2
2
-16.392 -20.171 -30.339 1.00140.13 N
-15.456 -21.035 -31.092 1.00140.13 C
-14.468 -20.202 -31.838 1.00140.13 C
-13.272 -20.492 -31.837 1.00140.13 O
-16.220 -21.911 -32.099 1.00140.13 C
-16.929 -21.120 -33.199 1.00140.13 C
-18.383 -20.178 -32.645 1.00140.13 S
-19.479 -21.621 -32.504 1.00140.13 C
-14.951 -19.121 -32.478 1.00 86.33 N
-14.079 -18.275 -33.229 1.00 86.33 C
我必须使用粘贴命令将上述文件按照以下格式放在一起,并在列之间留出相同的空格。
我尝试过这个:
paste a b c >bchain.pdb
ATOM 1149 N MET B 1 -16.392 -20.171 -30.339 1.00140.13 N
ATOM 1150 CA MET B 1 -15.456 -21.035 -31.092 1.00140.13 C
ATOM 1151 C MET B 1 -14.468 -20.202 -31.838 1.00140.13 C
ATOM 1152 O MET B 1 -13.272 -20.492 -31.837 1.00140.13 O
ATOM 1153 CB MET B 1 -16.220 -21.911 -32.099 1.00140.13 C
ATOM 1154 CG MET B 1 -16.929 -21.120 -33.199 1.00140.13 C
ATOM 1155 SD MET B 1 -18.383 -20.178 -32.645 1.00140.13 S
ATOM 1156 CE MET B 1 -19.479 -21.621 -32.504 1.00140.13 C
ATOM 1157 N SER B 2 -14.951 -19.121 -32.478 1.00 86.33 N
ATOM 1158 CA SER B 2 -14.079 -18.275 -33.229 1.00 86.33 C
但预期输出
ATOM 1149 N MET B 1 -16.392 -20.171 -30.339 1.00140.13 N
..........
ATOM 1209 N ARG B 10 3.940 -0.720 -30.221 1.00 88.10 N
...........
ATOM 1882 N SER B 100 -4.110 -12.604 -45.170 1.00 88.85 N
答案1
paste
如果您的文件已经有您需要的间距,只需告诉不要添加任何分隔符
$ paste -d '' a b c
ATOM 1149 N MET B 1 -16.392 -20.171 -30.339 1.00140.13 N
ATOM 1150 CA MET B 1 -15.456 -21.035 -31.092 1.00140.13 C
ATOM 1151 C MET B 1 -14.468 -20.202 -31.838 1.00140.13 C
ATOM 1152 O MET B 1 -13.272 -20.492 -31.837 1.00140.13 O
ATOM 1153 CB MET B 1 -16.220 -21.911 -32.099 1.00140.13 C
ATOM 1154 CG MET B 1 -16.929 -21.120 -33.199 1.00140.13 C