From owner-chemistry@ccl.net Fri Jan 10 06:38:01 2014 From: "Radhika Narayanan Nair radhika.narayanan.n(!)gmail.com" To: CCL Subject: CCL:G: IR spectra of amorphous and crystalline solids Message-Id: <-49532-140110063640-6539-gMJ4SwB2nBbgmQXD9fisEQ_+_server.ccl.net> X-Original-From: "Radhika Narayanan Nair" Date: Fri, 10 Jan 2014 06:36:38 -0500 Sent to CCL by: "Radhika Narayanan Nair" [radhika.narayanan.n .. gmail.com] Dear all, I am dealing with IR spectra of solids. I would like to know whether it is possible to analyse the IR spectra of amorphous and crystalline solids using Gaussian or any other software? Thanks in advance Sincerely, Radhika From owner-chemistry@ccl.net Fri Jan 10 07:44:00 2014 From: "Sidra Rafi sidrarafi89^^gmail.com" To: CCL Subject: CCL: how i can prepare antigen-antibody by using GROMACS Message-Id: <-49533-140110040231-726-X9fcqWxJ/PoOJSZEgqmIyw+*+server.ccl.net> X-Original-From: "Sidra Rafi" Date: Fri, 10 Jan 2014 04:02:30 -0500 Sent to CCL by: "Sidra Rafi" [sidrarafi89-#-gmail.com] i have antigen as protein and antibody as ligand , now i want to run this protein-protein simulation by using GROMACS . how i can prepare my antigen and antibody by Gromacs? From owner-chemistry@ccl.net Fri Jan 10 08:19:00 2014 From: "Sidra Rafi sidrarafi89]|[gmail.com" To: CCL Subject: CCL: how i can prepare antigen-antibody by using GROMACS Message-Id: <-49534-140110041844-1538-peijPlaOKHMmUHtwjNbSiw=-=server.ccl.net> X-Original-From: "Sidra Rafi" Date: Fri, 10 Jan 2014 04:18:43 -0500 Sent to CCL by: "Sidra Rafi" [sidrarafi89~~gmail.com] i have antigen as protein and antibody as ligand , now i want to run this protein-protein simulation by using GROMACS . how i can prepare my antigen and antibody by Gromacs? From owner-chemistry@ccl.net Fri Jan 10 13:07:01 2014 From: "Julio Dominguez acheron24**hotmail.com" To: CCL Subject: CCL: how i can prepare antigen-antibody by using GROMACS Message-Id: <-49535-140110111800-20168-ll8b5Fz/qSHWSV0uwO2qEg###server.ccl.net> X-Original-From: Julio Dominguez Content-Type: multipart/alternative; boundary="_e6577f2c-5c4b-409c-8aac-034ff046f3a6_" Date: Fri, 10 Jan 2014 16:17:53 +0000 MIME-Version: 1.0 Sent to CCL by: Julio Dominguez [acheron24 : hotmail.com] --_e6577f2c-5c4b-409c-8aac-034ff046f3a6_ Content-Type: text/plain; charset="iso-8859-1" Content-Transfer-Encoding: quoted-printable Sidra=2C Here is a short tutorial=2C it is the easiest I have seen online: http://manual.gromacs.org/online/speptide.html > From: owner-chemistry_+_ccl.net > To: acheron24_+_hotmail.com > Subject: CCL: how i can prepare antigen-antibody by using GROMACS > Date: Fri=2C 10 Jan 2014 04:02:30 -0500 >=20 >=20 > Sent to CCL by: "Sidra Rafi" [sidrarafi89-#-gmail.com] > i have antigen as protein and antibody as ligand =2C now i want to run th= is protein-protein simulation by using GROMACS . how i can prepare my antig= en and antibody by Gromacs? >=20 >=20 >=20 > -=3D This is automatically added to each message by the mailing script = =3D- > To recover the email address of the author of the message=2C please chang= e>=20>=20>=20 > Subscribe/Unsubscribe:=20>=20 > Before posting=2C check wait time at: http://www.ccl.net >=20 > Job: http://www.ccl.net/jobs=20>=20>=20 > If your mail bounces from CCL with 5.7.1 error=2C check:>=20>=20 >=20 = --_e6577f2c-5c4b-409c-8aac-034ff046f3a6_ Content-Type: text/html; charset="iso-8859-1" Content-Transfer-Encoding: quoted-printable

Sidra=2C<= div>
Here is a short tutorial=2C it is the easiest I have see= n online:




>=3B From: owner-chemi= stry_+_ccl.net
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>=3B Subject: CCL: ho= w i can prepare antigen-antibody by using GROMACS
>=3B Date: Fri=2C 10= Jan 2014 04:02:30 -0500
>=3B
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>=3B Sent to CCL by: "S= idra Rafi" [sidrarafi89-#-gmail.com]
>=3B i have antigen as protein a= nd antibody as ligand =2C now i want to run this protein-protein simulation= by using GROMACS . how i can prepare my antigen and antibody by Gromacs?>=3B
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