Solvent Effects | List of Frontiers open access articles

Original Research

Published on 04 Oct 2022

Processing helix–coil transition data: Account of chain length and solvent effects

in Computational Nanotechnology

Knarik Yeritsyan
Matjaz Valant
Artem Badasyan

Frontiers in Nanotechnology

doi 10.3389/fnano.2022.982644

2,621 views
3 citations

Review

Published on 25 Feb 2016

The Clusters-in-a-Liquid Approach for Solvation: New Insights from the Conformer Specific Gas Phase Spectroscopy and Vibrational Optical Activity Spectroscopy

in Chemical Physics and Physical Chemistry

Angelo S. Perera
Javix Thomas
Mohammad R. Poopari
Yunjie Xu

Frontiers in Chemistry

doi 10.3389/fchem.2016.00009

8,764 views
78 citations

Review

Published on 27 Apr 2023

Solvent and solvation effects on reactivities and mechanisms of phospho group transfers from phosphate and phosphinate esters to nucleophiles

in Organic Chemistry

Ikenna Onyido
Onyeka F. Obumselu
Chinyelu I. Egwuatu
Nkechi H. Okoye

Frontiers in Chemistry

doi 10.3389/fchem.2023.1176746

10,178 views
6 citations

Original Research

Published on 03 Sep 2019

Establishing Predictive Models for Solvatochromic Parameters of Ionic Liquids

in Theoretical and Computational Chemistry

Vishwesh Venkatraman
Kallidanthiyil Chellappan Lethesh

Frontiers in Chemistry

doi 10.3389/fchem.2019.00605

4,723 views
12 citations

Original Research

Published on 07 Jul 2020

CPL Spectra of Camphor Derivatives in Solution by an Integrated QM/MD Approach

in Chemical Physics and Physical Chemistry

Sara Del Galdo
Marco Fusè
Vincenzo Barone

Frontiers in Chemistry

doi 10.3389/fchem.2020.00584

4,318 views
10 citations

Original Research

Published on 03 Aug 2021

Atomic-Level Investigation of Reactant Recognition Mechanism and Thermodynamic Property in Glucosamine 6-Phosphate Deaminase Catalysis

in Theoretical and Computational Chemistry

Xiao Zhang
Xiaoyuan Liu
Zhiyang Zhang
Yuan Zhao
Chaojie Wang

Frontiers in Chemistry

doi 10.3389/fchem.2021.737492

3,198 views
3 citations

Articles

Processing helix–coil transition data: Account of chain length and solvent effects

The Clusters-in-a-Liquid Approach for Solvation: New Insights from the Conformer Specific Gas Phase Spectroscopy and Vibrational Optical Activity Spectroscopy

Solvent and solvation effects on reactivities and mechanisms of phospho group transfers from phosphate and phosphinate esters to nucleophiles

Establishing Predictive Models for Solvatochromic Parameters of Ionic Liquids

CPL Spectra of Camphor Derivatives in Solution by an Integrated QM/MD Approach

Atomic-Level Investigation of Reactant Recognition Mechanism and Thermodynamic Property in Glucosamine 6-Phosphate Deaminase Catalysis