From owner-chemistry(+ at +)ccl.net Wed Sep 21 15:21:15 2005
From: "CCL" <owner-chemistry;;server.ccl.net>
To: CCL
Subject: CCL: input structure creation/editing
Message-Id: <-29253-050921131443-32165-eQDf/0HnEqikT/Cap9txwA;;server.ccl.net>
X-Original-From: Konstantin Ivanov <konsantin.iv;;gmail.com>
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Date: Wed, 21 Sep 2005 12:12:25 -0400
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Sent to CCL by: Konstantin Ivanov [konsantin.iv;;gmail.com]

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Dear CCLers,
 which program running under GNU/Linux would you recommend for the creation
and editing of the input structures
for the quantum-chemical calculations? Molden is good for inputs using
Z-matrices, but is very inconvenient for the free-hand "fine-tuning" of the
guess structures, say for the transition states. Ghemical is not bad but it=
s
development seem to be stopped.
Something as simple as the editor built-in in WebMO would be good...
 Thank you.
  Best regards,
Konstantin Ivanov

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<div>Dear CCLers,</div>
<div>&nbsp;</div>
<div>which program&nbsp;running under GNU/Linux would you recommend for the=
 creation and editing of the input structures </div>
<div>for the quantum-chemical calculations? Molden is good for inputs using=
 Z-matrices, but is very inconvenient for the free-hand&nbsp;&quot;fine-tun=
ing&quot; of the guess structures, say for the transition states. Ghemical =
is not bad but its development seem to be stopped.=20
</div>
<div>Something as simple as the editor built-in in WebMO would be good...</=
div>
<div>&nbsp;</div>
<div>Thank you.</div>
<div>&nbsp;</div>
<div>&nbsp;</div>
<div>Best regards,<br clear=3D"all">&nbsp;&nbsp; Konstantin Ivanov </div>

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