From owner-chemistry@ccl.net Mon Jul 2 09:28:00 2012 From: "Jan Jensen jhjensen ~~ chem.ku.dk" To: CCL Subject: CCL: Computational Chemistry Highlights: June isse Message-Id: <-47160-120702055122-19448-IH+vapOhCu6OTPSzpaz0Xg||server.ccl.net> X-Original-From: "Jan Jensen" Date: Mon, 2 Jul 2012 05:51:20 -0400 Sent to CCL by: "Jan Jensen" [jhjensen*chem.ku.dk] The June issue of Computational Chemistry Highlights is out. http://www.compchemhighlights.org/2012_06_01_archive.html CCH is an overlay journal that identifies the most important papers in computational and theoretical chemistry published in the last 1-2 years. CCH is not affiliated with any publisher: it is a free resource run by scientists for scientists. Table of content for this issue features contributions from CCH editors Steven Bachrach, Grant Hill, and Jan Jensen: Accurate Predictions of Nonpolar Solvation Free Energies Require Explicit Consideration of Binding Site Hydration http://www.compchemhighlights.org/2012/06/accurate-predictions-of-nonpolar.html Tunnelling control of chemical reactions the organic chemist's perspective http://www.compchemhighlights.org/2012/06/tunnelling-control-of-chemical.html Accurate ab Initio Spin Densities http://www.compchemhighlights.org/2012/06/accurate-ab-initio-spin-densities.html Jailbreaking Benzene Dimers http://www.compchemhighlights.org/2012/06/jailbreaking-benzene-dimers.html Interpreting Protein Structural Dynamics from NMR Chemical Shifts http://www.compchemhighlights.org/2012/06/interpreting-protein-structural.html Interested in more? There are many ways to subscribe to CCH updates.