From owner-chemistry;at;ccl.net Tue Sep 8 09:12:01 2009 From: "Joaquin Barroso Flores joaco_barroso[*]yahoo.com" To: CCL Subject: CCL: Compound retrosynthesis Message-Id: <-40193-090908085743-5404-oXcxw6TW29Hpa6HCeTHAWA===server.ccl.net> X-Original-From: Joaquin Barroso Flores Content-Type: multipart/alternative; boundary="0-461306687-1252411050=:28281" Date: Tue, 8 Sep 2009 04:57:30 -0700 (PDT) MIME-Version: 1.0 Sent to CCL by: Joaquin Barroso Flores [joaco_barroso!^!yahoo.com] --0-461306687-1252411050=:28281 Content-Type: text/plain; charset=iso-8859-1 Content-Transfer-Encoding: quoted-printable I remember such program was the BSc thesis of a classmate of mine back at U= NAM in Mexico, about a decade ago. Try to get in touch with Dr. Ivan Tubert= -Brohman, he might still have the perl code. He is easy to find through Goo= gle so you shouldn't have a problem getting in touch with him.=20 On a different topic; I would like to encourage everyone on the list to rec= over what to me seems to be a lost practice on CCL, which is posting summar= ies to answers received.=20 Cheers =3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D= =3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D= =3D=3D =0AJoaquin Barroso-Flores, Ph. D. =0AFacultatea de Chimie, Universitatea Babes-Bolyai =0ACluj-Napoca, Romania =0A =0A -> http://joaquinbarroso.com =0A -> http://joaquinbarroso.wordpress.com =0A =0Ajoaquinbarroso''a''chem.ubbcluj.ro =0Ajoaquin.barroso''a''gmail.com=20 =0A =0A"Blogastronom=EDa": http://joaquinbarroso.blogspot.com=20 =0A=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D= =3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D= =3D=3D=3D --- El lun 7-sep-09, Werner K werner.schroedinger:googlemail.com escribi=F3: De:: Werner K werner.schroedinger:googlemail.com Asunto: CCL: Compound retrosynthesis A: "Flores, Joaquin Barroso " Fecha: lunes 7 de septiembre de 2009, 16:10 Sent to CCL by: "Werner=A0 K" [werner.schroedinger..googlemail.com] Hi, given a certain compound, for instance caffeina, I am looking for a softwar= e that can estimate the difficulty of its synthesis and if possible the dif= ferent synthetic routes, from commercial molecules. Thanks -=3D This is automatically added to each message by the mailing script =3D-=A0 =A0 =A0=A0 =A0 =A0Subscribe/Unsubscribe:=20 =A0 =A0 =A0Job: http://www.ccl.net/jobs=20=A0 =A0 =A0=0A=0A=0A Encuentra las mejores recetas en Yahoo! Cocina. = =0Ahttp://mx.mujer.yahoo.com/cocina/ --0-461306687-1252411050=:28281 Content-Type: text/html; charset=iso-8859-1 Content-Transfer-Encoding: quoted-printable
I remember such program was the BSc thesis of= a classmate of mine back at UNAM in Mexico, about a decade ago. Try to get= in touch with Dr. Ivan Tubert-Brohman, he might still have the perl code. = He is easy to find through Google so you shouldn't have a problem getting i= n touch with him.

On a different topic; I would like to encourage e= veryone on the list to recover what to me seems to be a lost practice on CC= L, which is posting summaries to answers received.

Cheers

= =3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D= =3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D= =3D=3D
=0AJoaquin Barroso-Flores, Ph. D.
=0AFacultatea de Chimie, Uni= versitatea Babes-Bolyai
=0ACluj-Napoca, Romania
=0A
=0A -> http= ://joaquinbarroso.com
=0A -> http://joaquinbarroso.wordpress.com
= =0A
=0Ajoaquinbarroso''a''chem.ubbcluj.ro
=0Ajoaquin.barroso''a''gmai= l.com
=0A
=0A"Blogastronom=EDa": http://joaquinbarroso.blogspot.com =
=0A=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D= =3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D=3D= =3D=3D=3D=3D=3D

--- El lun 7-sep-09, Werner K werner.schroedinger= :googlemail.com <owner-chemistry() ccl.net> escribi=F3:
<= blockquote style=3D"border-left: 2px solid rgb(16, 16, 255); margin-left: 5= px; padding-left: 5px;">
De:: Werner K werner.schroedinger:googlemail.co= m <owner-chemistry() ccl.net>
Asunto: CCL: Compound retrosynthesisA: "Flores, Joaquin Barroso " <joaco_barroso() yahoo.com>
= Fecha: lunes 7 de septiembre de 2009, 16:10


Sent to CCL by: "Werner  K" [werner.schroedinger..googlemail.com]=
Hi,

given a certain compound, for instance caffeina, I am lookin= g for a software that can estimate the difficulty of its synthesis and if p= ossible the different synthetic routes, from commercial molecules.

T= hanks



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