From: Boyang Wang (pkuwangboyang_at_yahoo.com.cn)
Date: Mon Dec 26 2005 - 21:40:56 CST
I am currently trying to look into the source code package /NAMD_2.6b1_Source , to find the part that calculates the potential energies of the system.
Would anybody who knows where it is give me a hint where to find it? From the files I looked into, I guess that most probably the energetics are calculated by the programs in /NAMD_2.6b1_Source/src/ directory, such as ComputeEField.C and other programs starting with Compute**. But I am still not sure if I am right.
I now list the directories of namd source code as follows:
Thanks for all your time.
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