VMD-L Mailing List

From: Gawtak Kim (shootgoaltag_at_gmail.com)
Date: Wed Feb 05 2020 - 23:13:25 CST

Thank you for your answers.

Then I can buy Gaussian16 without anxiety.

But, if the official version of VMD 1.9.4 (Windows OpenGL) has to be
released for the full compatibility with Gaussian16,
when would the official version be released?

Best regards,
Gawtak

2020년 2월 6일 (목) 오전 2:45, David Sáez <davidsaezsan_at_gmail.com>님이 작성:

> The ORCA support is great news.
>
> Thanks!
>
> On Wed, Feb 5, 2020 at 1:09 PM <giuseppe_at_ks.uiuc.edu> wrote:
>
>> Dear David and Kim,
>> to answer your question, we have not yet release a version of ffTK that is
>> fully compatible with G16 because we could not access G16 license yet. We
>> will hopefully have the license in a couple of weeks and do the
>> appropriate changes to support G16. Meanwhile, I would like to inform you
>> that the latest alpha version of VMD 1.9.4 contains an updated version of
>> ffTK that supports the use of ORCA quantum package (and additional bug
>> fixes). Please try it out if you wish.
>>
>> Best regards,
>> Giuseppe Licari
>>
>> From: <owner-vmd-l_at_ks.uiuc.edu> on behalf of David Sáez
>> <davidsaezsan_at_gmail.com>
>> Date: Wednesday, February 5, 2020 at 05:05
>> To: Gawtak Kim <shootgoaltag_at_gmail.com>
>> Cc: "vmd-l_at_ks.uiuc.edu" <vmd-l_at_ks.uiuc.edu>
>> Subject: Re: vmd-l: Gaussian16 support issue of ffTK
>>
>> Hello,
>>
>> My experience:
>>
>> https://www.ks.uiuc.edu/Research/vmd/mailing_list/vmd-l/31355.html
>>
>> Regards,
>>
>> David.
>>
>> El mié., 5 de febrero de 2020 5:08 a. m., Gawtak Kim
>> <shootgoaltag_at_gmail.com> escribió:
>> Hi.
>>
>> I use VMD Version 1.9.3 (Windows OpenGL) and
>> I have read the tutorial manual, "Parameterizing Small Molecules Using the
>> Force Field Toolkit (ffTK)."
>>
>> In Section 1.3 "Software and Knowledge Prerequisites" (p.5) of this
>> manual,
>> I could find the statement, "Currently, ffTK only supports the use of
>> Gaussian09 for these calculations, and it is suggested that users obtain
>> access to this commercial software package."
>>
>> Does ffTK also support Gaussian16?
>>
>> Best regards,
>> Gawtak
>>
>>