AMBER: (no subject)

From: Narang Manpreet Kaur <preetdbs.iitr.ernet.in>
Date: Tue, 5 Aug 2003 18:55:57 +0500 (GMT)

 Dear AMBER users,
                   I want to add a a waterbox with with different x, y,
and z dimensions. Please suggest
I tried the following
solvatebox commar WATBOX216 30.17 31.27 49.96
Solute vdw bounding box:
23.043 21.954 26.720
Total bounding box for atom centers: 83.383 82.294 87.060
Solvent unit box: 18.774 18.774 18.774
Total vdw box size: 23.043 21.954 26.720 angstroms.
Volume: 13517.515 A^3
Total mass 4463.392 amu, Density 0.548 g/cc
Added 0 residues.
Why zero residues added?
Thanking you
Manpreet Kaur Narang
Research Scholar
Deptt.Biotechnology
Indian Institute of Technology Roorkee (IITR)
Roorkee, 247 667 India



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Received on Tue Aug 05 2003 - 14:53:01 PDT
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