[gmx-users] Doubt about -linfix, -linacc, -radfix, -radacc, -radcon

2007-09-21 Thread Anirban Ghosh
Hi All, I want to perform ED sampling along first principle component in GROMACS. For that I am using the make_edi command to generate the required .edi file to be subsequently used in mdrun. But I cannot understand the meaning of the algorithms -linfix, -linacc, -radfix, -radacc and -radcon. What

Re: [gmx-users] Doubt about -linfix, -linacc, -radfix, -radacc, -radcon

2007-09-21 Thread Bert de Groot
-- Anirban Ghosh wrote: Hi All, I want to perform ED sampling along first principle component in GROMACS. For that I am using the make_edi command to generate the required .edi file to be subsequently used in mdrun. But I cannot understand the meaning of the algorithms -linfix, -linacc,