Re: [gmx-users] Set up anti parallel membrane system for CompEL simulation

2020-05-04 Thread Zheng Ruan
Hi Jochen, Thank you for the suggestions. Best, Zheng On Mon, May 4, 2020 at 5:24 PM Jochen Hub wrote: > > > Am 04.05.20 um 23:21 schrieb Jochen Hub: > > > > > > Am 04.05.20 um 21:33 schrieb Zheng Ruan: > >> Hi, > >> > >> I'm trying to setup an antiparallel membrane system for CompEL > >>

Re: [gmx-users] Set up anti parallel membrane system for CompEL simulation

2020-05-04 Thread Jochen Hub
Am 04.05.20 um 23:21 schrieb Jochen Hub: Am 04.05.20 um 21:33 schrieb Zheng Ruan: Hi, I'm trying to setup an antiparallel membrane system for CompEL simulation. It is relatively straightforward to convert an existing single membrane system to a parallel system by using # gmx genconf -f

Re: [gmx-users] Set up anti parallel membrane system for CompEL simulation

2020-05-04 Thread Jochen Hub
Am 04.05.20 um 21:33 schrieb Zheng Ruan: Hi, I'm trying to setup an antiparallel membrane system for CompEL simulation. It is relatively straightforward to convert an existing single membrane system to a parallel system by using # gmx genconf -f system.gro -nbox 1 1 2 -o system.parallel.gro

[gmx-users] Set up anti parallel membrane system for CompEL simulation

2020-05-04 Thread Zheng Ruan
Hi, I'm trying to setup an antiparallel membrane system for CompEL simulation. It is relatively straightforward to convert an existing single membrane system to a parallel system by using # gmx genconf -f system.gro -nbox 1 1 2 -o system.parallel.gro However, is there an easy way to invert one