[gmx-users] RE: Where can I get .gro and .itp files for different models of water?

[Vitaly Chaban]

> I also wonder where I can get TIP3P.gro

You can easily construct *.gro files yourself using genconf utility if
you know the geometry of the model.



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Vitaly V. Chaban, Ph.D.(ABD)
School of Chemistry
V.N. Karazin Kharkiv National University
Svoboda sq.,4, Kharkiv 61077, Ukraine
email: chaban at univer.kharkov.ua,vvchaban at gmail.com
skype: vvchaban, mob.: +38-097-8259698