[gmx-users] Pdb files generated on Lincs warning

atb files atbfiles at zoho.com
Mon Nov 27 09:38:26 CET 2017


            Dear Users,When there is a Lincs warning (sometimes because of exceeding warnangle etc) the gromacs generates pdb files. My questions is:What is purpose of generating pdb files? What information they give? Which information we need to look for to analyse those pdbs. ThanksYogi Sent using Zoho Mail                              


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