[gmx-users] The sum of the two largest charge group radii

Akbar Shaikh Akbar.Shaikh at sparcmail.com
Fri Dec 8 09:42:10 CET 2017

You can try increasing the rlist value. It generally doesn't degrade the quality of your simulation results.

Akbar Shaikh

Information disclaimer: This email and any files transmitted with it are privileged and confidential and intended solely for the use of the individual or entity to whom they are addressed. If you are not the intended recipient or an agent responsible for delivering it to the intended recipient, you are hereby notified that you have received this email in error and you should not review, disseminate, distribute or copy this e-mail or any attachments contained herein. Please notify the sender immediately by e-mail and delete this e-mail from your system. E-mail transmission cannot be guaranteed to be secure or error-free as information could be intercepted, corrupted, lost, destroyed, arrive late or incomplete, or contain viruses. The sender therefore does not accept liability for any errors or omissions in the contents of this message, which arise as a result of e-mail transmission. The sender also confirms that it shall not be responsible if this email message is used for any indecent, unsolicited or illegal purposes, which are in violation of any existing laws and the same shall solely be the responsibility of misuser and that the sender shall at all times be indemnified of any civil and/ or criminal liabilities or consequences thereof. If verification is required please request a hard-copy version.

More information about the gromacs.org_gmx-users mailing list