[gmx-users] protein local density
dikov at imbg.org.ua
Mon Jan 10 15:40:20 CET 2005
Is there a way to calculate density of a protein packing somehow with GROMACS?
For example, I define asome space within protein molecule using atoms from an
index file and a program calculates volume and atoms density of that space.
If GROMACS cann't who knows the program that can do this?
Thanks in advance
Ph.D. Student Dmytro Kovalskyy
Institute of Molecular Biology & Genetics
150 Akad. Zabolotnogo Street,
E-mail: dikov at imbg.org.ua
Fax: +380 (44) 266-0759
Tel.: +380 (44) 266-5589
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