From owner-chemistry@ccl.net Tue Sep 5 01:30:01 2017 From: "Kshatresh Dutta Dubey kshatresh[-]gmail.com" To: CCL Subject: CCL: Help to get HARLEM or similar program for electron transfer Message-Id: <-52968-170905012916-19708-7bKW/FETwG0OukO47U+xBQ-*-server.ccl.net> X-Original-From: Kshatresh Dutta Dubey Content-Type: multipart/alternative; boundary="001a1143c1fcb9520a05586a8143" Date: Tue, 5 Sep 2017 08:29:09 +0300 MIME-Version: 1.0 Sent to CCL by: Kshatresh Dutta Dubey [kshatresh{}gmail.com] --001a1143c1fcb9520a05586a8143 Content-Type: text/plain; charset="UTF-8" Hi Jim, Thanks for the link. I have contacted Prof Kurnikova, and waiting for the reply. However, there is no mention of this program on above link. Thank you again and best regards Kshatresh On Tue, Sep 5, 2017 at 5:49 AM, Jim Kress jimkress35],[gmail.com < owner-chemistry{}ccl.net> wrote: > Did you try this: > > https://crete.chem.cmu.edu/index.php/contacts > > > > Jim > > > > *From:* owner-chemistry+jimkress35==gmail.com,+,ccl.net [mailto: > owner-chemistry+jimkress35==gmail.com,+,ccl.net] *On Behalf Of *Kshatresh > Dutta Dubey kshatresh]~[gmail.com > *Sent:* Monday, September 04, 2017 4:16 PM > *To:* Kress, Jim > *Subject:* CCL: Help to get HARLEM or similar program for electron > transfer > > > > Dear Users, > > > > In many of the articles related to biological electron transfer, I found > the citation of 'HARLEM' program (Kurnikov, I. V. HARLEM: > http://www.kurnikov.org/) for estimation of transfer integral. However, > this url is not found and I searched this program desperately on web but I > didn't get it. As per citations, this 'was' an open source program. > > I will highly appreciate if someone can suggest me/share me the link to > obtain this program. I will also appreciate any suggestion for a similar > program to calculate the ET rate in biological systems. > > > > Best regards > > Kshatresh > > > > > -- > > With best regards > > ************************************************************ > ************************************ > Kshatresh Dutta Dubey > > Post Doctoral Researcher, > > Lise Meitner Center for Computational Quantum Chemistry > Hebrew University of Jerusalem Israel > > Jerusalem, Israel > > -- With best regards ************************************************************************************************ Kshatresh Dutta Dubey Post Doctoral Researcher, Lise Meitner Center for Computational Quantum Chemistry Hebrew University of Jerusalem Israel Jerusalem, Israel --001a1143c1fcb9520a05586a8143 Content-Type: text/html; charset="UTF-8" Content-Transfer-Encoding: quoted-printable
Hi Jim,

Thanks for the link. I have con= tacted Prof Kurnikova, and waiting for the reply. However, there is no ment= ion of this program on above link.=C2=A0

Thank you= again and best regards
Kshatresh

On Tue, Sep 5, 2017 at 5:49 AM, Jim K= ress jimkress35],[gmail.com <owner-= chemistry{}ccl.net> wrote:
<= div lang=3D"EN-US" link=3D"blue" vlink=3D"purple">

Did you try this:

ht= tps://crete.chem.cmu.edu/index.php/contacts

=C2=A0

Jim=

=C2=A0

From: owner-chemistry+jimkress35=3D=3Dgmail.com,+,ccl.net [mailto:owner-chemistry+jimkress35=3D=3Dgmail.com,+,ccl.net] On Behalf Of Kshatresh D= utta Dubey kshatresh]~[gmail= .com
Sent: Monday, September 04, 2017 4:16 PM
To: K= ress, Jim <jimkress35,+,= gmail.com>
Subject: CCL: Help to get HARLEM or similar pro= gram for electron transfer

=C2=A0

Dear Use= rs,

=C2=A0

In many of the articles related to biologic= al electron transfer, I found the citation of 'HARLEM' program (Kur= nikov, I. V. HARLEM: http://www.kurnikov.org/) =C2=A0for estimation of transfer integral. H= owever, this url is not found and I searched this program desperately on we= b but I didn't get it. As per citations, this 'was' an open sou= rce program.=C2=A0

=C2= =A0I will highly appreciate if someone can suggest me/share me the link to = obtain this program. I will also appreciate any suggestion for a similar pr= ogram to calculate the ET rate in biological systems.

=C2=A0

Best regards

Kshatresh


=C2=A0=

--

<= div>

With best regards

*************************************************= ***********************************************
Kshatresh Dutt= a Dubey

Post Doctoral Re= searcher,

Lise Meitner C= enter for Computational Quantum Chemistry
Hebrew University of Jerusalem= Israel

Jerusalem, Israel



--
Wit= h best regards
**************************************************= **********************************************
Kshatresh Dutta Dubey
Post Doctoral Researcher,
Lise Meitner Center for Comp= utational Quantum Chemistry
Hebrew University of Jerusalem Israel
Jerusalem, Israel


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