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Hi Gromacs Developers,<br>
<br>
I am trying to use gromacs library to write my own C/C++ code for
trajectory analysis like reading out an arraylist of position data
from a single frame within an trajectory. So I am looking for
instructions on using the interface provided by gromacs source code.
Specifically, can anyone give me an example on how to make a
selection within the C/C++ code, e.g., select out all the C-alpha
atom positions from residue number 300-500.<br>
<br>
Thank you.<br>
Yunlong<br>
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========================================<br>
Yunlong Liu, PhD Candidate<br>
Computational Biology and Biophysics<br>
Department of Biophysics and Biophysical Chemistry<br>
School of Medicine, The Johns Hopkins University<br>
Email: <a class="moz-txt-link-abbreviated" href="mailto:yliu120@jhmi.edu">yliu120@jhmi.edu</a><br>
Address: 725 N Wolfe St, WBSB RM 601, 21205<br>
========================================<br>
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