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CCL
August 6, 2004
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From:
Takumi Hori <thori3jp*at*mac.com>
Date:
Fri, 6 Aug 2004 10:36:18 -0400
Subject:
pKa prediction with QM/MM
From:
Eric Bennett <ericb!at!pobox.com>
Date:
Fri, 06 Aug 2004 10:11:08 -0500
Subject:
Parallel Jaguar on x86-64 / MPI question
From:
"Pandey, Jaya" <JPandey)at(chla.usc.edu>
Date:
Fri, 6 Aug 2004 09:42:32 -0700
Subject:
Binding energy
From:
Konstantin Kudin <konstantin_kudin..at..yahoo.com>
Date:
Fri, 6 Aug 2004 06:54:43 -0700 (PDT)
Subject:
Re: CCL:SCF Convergence problem in G03
From:
Paul Momoh <momohpo.-at-.mail1.vcu.edu>
Date:
Fri, 06 Aug 2004 16:59:27 -0300
Subject:
CASSCF KEYWORD
From:
Don Steiger <dsteiger!at!bioeng.ucsd.edu>
Date:
Fri, 6 Aug 2004 17:12:48 -0700
Subject:
Solution of the multi-ion specie Poisson Boltzmann equation.