Difference between revisions of "Xmakemol"

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import>Mp466
 
import>Mp466
Line 9: Line 9:
 
189
 
189
   
LA 1.78570323034613 -10.9443958236924 2.45504189405983
+
LA 1.78570323034613 -10.9443958236924 2.45504189405983
LA 0.464015242641469 -11.3174520939861 1.75627872208277
+
LA 0.464015242641469 -11.3174520939861 1.75627872208277
LA 2.96647061767429 -8.84206324219249 2.72807666151128
+
LA 2.96647061767429 -8.84206324219249 2.72807666151128
 
'''
 
'''
   

Revision as of 21:55, 1 August 2008

A program for visualizing atomic and molecular systems. It is fast and flexible enough to view clusters, and bioploymers The input format has one atom per line with an atom id followed by coordinates in x,y,z format. The first line of the file has the number of atoms in the system.

for example

    189
    LA    1.78570323034613       -10.9443958236924        2.45504189405983
    LA   0.464015242641469       -11.3174520939861        1.75627872208277
    LA    2.96647061767429       -8.84206324219249        2.72807666151128

Commands

xmakemol -f <file>