A comparative theoretical study of dipeptide solvation in water (English)
- New search for: Hugosson, Håkan W.
- New search for: Hugosson, Håkan W.
- New search for: Laio, Alessandro
- New search for: Maurer, Patrick
- New search for: Rothlisberger, Ursula
In:
Journal of computational chemistry
;
27
, 5
; 672
;
2006
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ISSN:
- Article (Journal) / Print
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Title:A comparative theoretical study of dipeptide solvation in water
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Contributors:
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Published in:Journal of computational chemistry ; 27, 5 ; 672
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Publisher:
- New search for: Wiley
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Place of publication:New York, NY
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Publication date:2006
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ISSN:
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ZDBID:
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Type of media:Article (Journal)
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Type of material:Print
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Language:English
- New search for: 770/3155/3600
- New search for: 35.05 / 35.05
- Further information on Basic classification
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Keywords:
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Classification:
Local classification TIB: 770/3155/3600 BKL: 35.05 / 35.05 Mathematische Chemie, chemische Statistik -
Source:
Table of contents – Volume 27, Issue 5
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
- 537
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Modified calculations of hydrocarbon thermodynamic propertiesLiu, Min Hsien / Chen, Cheng et al. | 2006
- 545
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Ylidic radical–molecule reactionsXie, Hong‐Bin / Ding, Yi‐Hong / Sun, Chia‐Chung et al. | 2006
- 552
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Computation of hydration free energies of organic solutes with an implicit water modelBasilevsky, Mikhail V. / Leontyev, Igor V. / Luschekina, Sofia V. / Kondakova, Olga A. / Sulimov, Vladimir B. et al. | 2006
- 571
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Are calculated enthalpies of formation sometimes more reliable than experimental? A test on alkyl substituted benzoic acidsBöhm, Stanislav / Exner, Otto et al. | 2006
- 578
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Monosilicon‐substituted cyanoacetylene: A computational studyYang, Li‐Ming / Ding, Yi‐Hong / Wang, Qiang / Sun, Chia‐Chung et al. | 2006
- 596
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An orbital localization criterion based on the theory of “fuzzy” atomsAlcoba, Diego R. / Lain, Luis / Torre, Alicia / Bochicchio, Roberto C. et al. | 2006
- 609
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Singular value decomposition of torsional angles of analogs of the dopamine reuptake inhibitor GBR 12909Fiorentino, Anna / Pandit, Deepangi / Gilbert, Kathleen M. / Misra, Milind / Dios, Rose / Venanzi, Carol A. et al. | 2006
- 621
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A consensus procedure improving solvent accessibility predictionGianese, Giulio / Pascarella, Stefano et al. | 2006
- 627
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The VMFCI method: A flexible tool for solving the molecular vibration problemCassam‐Chenaï, P. / Liévin, J. et al. | 2006
- 641
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Radical reaction C3H+NO: A mechanistic studyXie, Hong‐Bin / Ding, Yi‐Hong / Sun, Chia‐Chung et al. | 2006
- 661
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Theoretical mechanistic study on the radical‐molecule reaction of CHCl2/CCl3 with NO2Zhang, Jia‐Xu / Li, Ze‐Sheng / Liu, Jing‐Yao / Sun, Chia‐Chung et al. | 2006
- 672
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A comparative theoretical study of dipeptide solvation in waterHugosson, Håkan W. / Laio, Alessandro / Maurer, Patrick / Rothlisberger, Ursula et al. | 2006