Rolf Huehne wrote:
>Bob Hanson wrote:
>
>
>>OK, well, then, since they messed up there, I highly recommend you use
>>"connect" just after loading. I've added the test for between-model
>>bonding in Jmol 11.3.48
>>
>>
>>
>I don't fully trust the connect mechanism in Jmol (I saw for example
Rolf Huehne wrote:
>Bob Hanson wrote:
>
>
>>OK, well, then, since they messed up there, I highly recommend you use
>>"connect" just after loading. I've added the test for between-model
>>bonding in Jmol 11.3.48
>>
>>
>>
>I don't fully trust the connect mechanism in Jmol (I saw for example
Rolf, thanks for spotting this. It was a bug. Fixed for 11.3.51
Rolf Huehne wrote:
> Hi all,
>
>among others there are the following predefined residue sets available
>in Jmol: "amino" and "protein".
>
>The documentation at "http://chemapps.stolaf.edu/jmol/docs/"; states that
> "amino" is d
Bob Hanson wrote:
> OK, well, then, since they messed up there, I highly recommend you use
> "connect" just after loading. I've added the test for between-model
> bonding in Jmol 11.3.48
>
I don't fully trust the connect mechanism in Jmol (I saw for example
hydrogen atoms bonded covalently with
Message: 1
Date: Wed, 28 Nov 2007 08:44:30 +
From: David Leader <[EMAIL PROTECTED]>
Subject: Re: [Jmol-users] new.htm updated
To: jmol-users@lists.sourceforge.net
Message-ID: <[EMAIL PROTECTED]>
Content-Type: text/plain; charset=US-ASCII; delsp=yes; format=flowed
Bob wrote:
I've updated
h
Hi all,
among others there are the following predefined residue sets available
in Jmol: "amino" and "protein".
The documentation at "http://chemapps.stolaf.edu/jmol/docs/"; states that
"amino" is defined as "all twenty standard amino acids, plus ASX, GLX,
UNK".
For "protein" it states as
- Original Message -
From: Angel Herraez <[EMAIL PROTECTED]>
Date: Friday, November 30, 2007 3:12 am
Subject: Re: [Jmol-users] Handling Isotopes
To: jmol-users@lists.sourceforge.net
> ...
> BTW, I just found that (Elsevier) MDL has changed name again, it is
> Symyx now !?
The ISIS produ
Angel Herraez wrote:
> OK, just for the records, this is the support for isotopes in MOL and
> SD(F), as described in the official MDL guide:
>
> 1) in an atom line:
> x.y.z. aaaddcccssshhhbbbvvvHHHrrriiimmmnnneee
> the "dd" positions are the mass difference, from -3 to +4
OK, just for the records, this is the support for isotopes in MOL and SD(F), as described in
the official MDL guide:
1) in an atom line:
x.y.z. aaaddcccssshhhbbbvvvHHHrrriiimmmnnneee
the "dd" positions are the mass difference, from -3 to +4
9 matches
Mail list logo
