Literature DB >> 16092826

Quantum mechanical continuum solvation models.

Jacopo Tomasi1, Benedetta Mennucci, Roberto Cammi.   

Abstract

Year:  2005        PMID: 16092826     DOI: 10.1021/cr9904009

Source DB:  PubMed          Journal:  Chem Rev        ISSN: 0009-2665            Impact factor:   60.622


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  1131 in total

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Journal:  Chem Rev       Date:  2020-06-29       Impact factor: 60.622

3.  EPR and Quantum Chemical Studies of the pH-sensitive Imidazoline and Imidazolidine Nitroxides with Bulky Substituents.

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4.  Differential geometry based solvation model II: Lagrangian formulation.

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7.  Side-chain to backbone interactions dictate the conformational preferences of a cyclopentane arginine analogue.

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8.  Biologically important conformational features of DNA as interpreted by quantum mechanics and molecular mechanics computations of its simple fragments.

Authors:  V Poltev; V M Anisimov; V Dominguez; E Gonzalez; A Deriabina; D Garcia; F Rivas; N A Polteva
Journal:  J Mol Model       Date:  2018-02-01       Impact factor: 1.810

9.  A fluorogenic probe for the catalyst-free detection of azide-tagged molecules.

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10.  Reconciliation of chemical, enzymatic, spectroscopic and computational data to assign the absolute configuration of the DNA base lesion spiroiminodihydantoin.

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