Molecular theory of partial molar volume and its applications to biomolecular systems

The partial molar volume (PMV) is a thermodynamic quantity which contains important information about the solute-solvent interactions as well as the solute structure in solution. Additionally, the PMV is the most essential quantity in the analysis of the pressure effect on chemical reactions. This...

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Дата:2007
Автор: Imai, T.
Формат: Стаття
Мова:English
Опубліковано: Інститут фізики конденсованих систем НАН України 2007
Назва видання:Condensed Matter Physics
Онлайн доступ:http://dspace.nbuv.gov.ua/handle/123456789/118699
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Назва журналу:Digital Library of Periodicals of National Academy of Sciences of Ukraine
Цитувати:Molecular theory of partial molar volume and its applications to biomolecular systems / T. Imai // Condensed Matter Physics. — 2007. — Т. 10, № 3(51). — С. 343-361. — Бібліогр.: 124 назв. — англ.

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Digital Library of Periodicals of National Academy of Sciences of Ukraine
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spelling irk-123456789-1186992017-06-01T03:05:51Z Molecular theory of partial molar volume and its applications to biomolecular systems Imai, T. The partial molar volume (PMV) is a thermodynamic quantity which contains important information about the solute-solvent interactions as well as the solute structure in solution. Additionally, the PMV is the most essential quantity in the analysis of the pressure effect on chemical reactions. This article reviews the recent developments in molecular theories of the PMV, especially the reference interaction site model (RISM) theory of molecular liquids and its three-dimensional generalization version (3D-RISM), which are combined with the Kirkwood-Buff solution theory to calculate the PMV. This article also introduces our recent applications of the theory to some interesting issues concerning the PMV of biomolecules. In addition, theoretical representations of the effects of intramolecular fluctuation on the PMV, which are significant for biomacromolecules, are briefly discussed. Парцiальний молярний об’єм (PMV) є термодинамiчною величиною, яка мiстить важливу iнформацiю про взаємодiї розчинена речовина-розчинник, а також про структуру розчиненої речовини в розчинi. Крiм того, PMV є найбiльш суттєвою величиною при аналiзi впливу тиску на перебiг хiмiчної реакцiї. Ця стаття мiстить огляд сучасного стану молекулярних теорiй PMV, зокрема, молекулярної теорiї базисної моделi взаємодiючих центрiв (RISM) i її тривимiрного узагальнення (3D-RISM), якi, для обчислення PMV, є об’єднанi з теорiєю Кiрквуда-Баффа для розчинiв. Тут також представленi застосування теорiї для ряду випадкiв, що стосуються PMV бiомолекул. Ми також коротко обговорюємо вплив мiжмолекулярних флуктуацiй на PMV, який є важливими для бiомакромолекул. 2007 Article Molecular theory of partial molar volume and its applications to biomolecular systems / T. Imai // Condensed Matter Physics. — 2007. — Т. 10, № 3(51). — С. 343-361. — Бібліогр.: 124 назв. — англ. 1607-324X PACS: 05.20.Jj, 05.70.Ce, 62.50.+p, 65.20.+w, 82.60.Lf, 87.15.Aa DOI:10.5488/CMP.10.3.343 http://dspace.nbuv.gov.ua/handle/123456789/118699 en Condensed Matter Physics Інститут фізики конденсованих систем НАН України
institution Digital Library of Periodicals of National Academy of Sciences of Ukraine
collection DSpace DC
language English
description The partial molar volume (PMV) is a thermodynamic quantity which contains important information about the solute-solvent interactions as well as the solute structure in solution. Additionally, the PMV is the most essential quantity in the analysis of the pressure effect on chemical reactions. This article reviews the recent developments in molecular theories of the PMV, especially the reference interaction site model (RISM) theory of molecular liquids and its three-dimensional generalization version (3D-RISM), which are combined with the Kirkwood-Buff solution theory to calculate the PMV. This article also introduces our recent applications of the theory to some interesting issues concerning the PMV of biomolecules. In addition, theoretical representations of the effects of intramolecular fluctuation on the PMV, which are significant for biomacromolecules, are briefly discussed.
format Article
author Imai, T.
spellingShingle Imai, T.
Molecular theory of partial molar volume and its applications to biomolecular systems
Condensed Matter Physics
author_facet Imai, T.
author_sort Imai, T.
title Molecular theory of partial molar volume and its applications to biomolecular systems
title_short Molecular theory of partial molar volume and its applications to biomolecular systems
title_full Molecular theory of partial molar volume and its applications to biomolecular systems
title_fullStr Molecular theory of partial molar volume and its applications to biomolecular systems
title_full_unstemmed Molecular theory of partial molar volume and its applications to biomolecular systems
title_sort molecular theory of partial molar volume and its applications to biomolecular systems
publisher Інститут фізики конденсованих систем НАН України
publishDate 2007
url http://dspace.nbuv.gov.ua/handle/123456789/118699
citation_txt Molecular theory of partial molar volume and its applications to biomolecular systems / T. Imai // Condensed Matter Physics. — 2007. — Т. 10, № 3(51). — С. 343-361. — Бібліогр.: 124 назв. — англ.
series Condensed Matter Physics
work_keys_str_mv AT imait moleculartheoryofpartialmolarvolumeanditsapplicationstobiomolecularsystems
first_indexed 2023-10-18T20:32:44Z
last_indexed 2023-10-18T20:32:44Z
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