Samantha Weerasinghe: search on Z-Library

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1

A Kirkwood-Buff Derived Force Field for Aqueous Alkali Halides

Gee, Moon Bae, Cox, Nicholas R., Jiao, Yuanfang, Bentenitis, Nikolaos, Weerasinghe, Samantha, Smith, Paul E.

Journal:

Journal of Chemical Theory and Computation

Year:

2011

Language:

english

File:

PDF, 1.68 MB

english, 2011

2

Molecular phylogenetics and biogeography of the Neocellia Series of Anopheles mosquitoes in the Oriental Region

Katy Morgan, Samantha M. O’Loughlin, Fong Mun-Yik, Yvonne-Marie Linton, Pradya Somboon, Sein Min, Pe Than Htun, Simone Nambanya, Indira Weerasinghe, Tho Sochantha, Anil Prakash, Catherine Walton

Journal:

Molecular Phylogenetics and Evolution

Year:

2009

Language:

english

File:

PDF, 897 KB

english, 2009

3

Effects of Hydrogen Bonding on the Rotational Dynamics of Water-Like Molecules in Liquids: Insights from Molecular Dynamics Simulations

Madhavi, W. A. Monika, Weerasinghe, Samantha, Momot, Konstantin I.

Journal:

Australian Journal of Chemistry

Year:

2020

File:

PDF, 990 KB

2020

4

Development of a molecular mechanics force field for caffeine to investigate the interactions of caffeine in different solvent media

Rangana Sanjeewa, Samantha Weerasinghe

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2010

Language:

english

File:

PDF, 3.60 MB

english, 2010

5

Reorientational dynamics of molecules in liquid methane: A molecular dynamics simulation study

Madhavi, W.A. Monika, Weerasinghe, Samantha, Momot, Konstantin I.

Journal:

Journal of Molecular Liquids

Year:

2020

File:

PDF, 1.57 MB

2020

6

Cavity formation and preferential interactions in urea solutions: Dependence on urea aggregation

Weerasinghe, Samantha, Smith, Paul E.

Journal:

The Journal of Chemical Physics

Year:

2003

Language:

english

File:

PDF, 414 KB

english, 2003

7

Simulation of structural and functional properties of mevalonate diphosphate decarboxylase (MVD)

Samantha Weerasinghe, Ranil Samantha Dassanayake

Journal:

Journal of Molecular Modeling

Year:

2010

Language:

english

File:

PDF, 962 KB

english, 2010

8

Absolute classical densities of states for very anharmonic systems and applications to the evaporation of rare gas clusters

Weerasinghe, Samantha, Amar, François G.

Journal:

The Journal of Chemical Physics

Year:

1993

Language:

english

File:

PDF, 1.53 MB

english, 1993

9

Theory and Simulation of Multicomponent Osmotic Systems

Karunaweera, Sadish, Gee, Moon Bae, Weerasinghe, Samantha, Smith, Paul E.

Journal:

Journal of Chemical Theory and Computation

Year:

2012

Language:

english

File:

PDF, 1.60 MB

english, 2012

10

Ideal chemical potential contribution in molecular dynamics simulations of the grand canonical ensemble

Weerasinghe, Samantha, Pettitt, B. Montgomery

Journal:

Molecular Physics

Year:

1994

Language:

english

File:

PDF, 770 KB

english, 1994

11

Study of aggregate formation of caffeine in water by molecular dynamics simulation

Rangana Sanjeewa, Samantha Weerasinghe

Journal:

Computational and Theoretical Chemistry

Year:

2011

Language:

english

File:

PDF, 1.62 MB

english, 2011

12

Recent Applications of Kirkwood–Buff Theory to Biological Systems

Veronica Pierce, Myungshim Kang, Mahalaxmi Aburi, Samantha Weerasinghe, Paul E. Smith

Journal:

Cell Biochemistry and Biophysics

Year:

2008

Language:

english

File:

PDF, 629 KB

english, 2008

13

A Kirkwood-Buff derived force field for the simulation of aqueous guanidinium chloride solutions

Weerasinghe, Samantha, Smith, Paul E.

Journal:

The Journal of Chemical Physics

Year:

2004

Language:

english

File:

PDF, 325 KB

english, 2004

14

A Kirkwood−Buff Derived Force Field for Methanol and Aqueous Methanol Solutions

Weerasinghe, Samantha, Smith, Paul E.

Journal:

Journal of Physical Chemistry B

Year:

2005

Language:

english

File:

PDF, 105 KB

english, 2005

15

A Kirkwood−Buff Derived Force Field for Mixtures of Urea and Water

Weerasinghe, Samantha, Smith, Paul E.

Journal:

Journal of Physical Chemistry B

Year:

2003

Language:

english

File:

PDF, 256 KB

english, 2003

16

An In Silico Approach of Coumarin-Derived Inhibitors for Human DNA Topoisomerase I

Guruge, Amali G., Udawatte, Chandani, Weerasinghe, Samantha

Journal:

Australian Journal of Chemistry

Year:

2016

Language:

english

File:

PDF, 2.51 MB

english, 2016

17

Exploring the binding properties of agonists interacting with glucocorticoid receptor: an in silico approach

Rathnayake, Samith, Weerasinghe, Samantha

Journal:

Journal of Molecular Modeling

Year:

2018

Language:

english

File:

PDF, 7.29 MB

english, 2018

18

Kirkwood–Buff derived force field for mixtures of acetone and water

Weerasinghe, Samantha, Smith, Paul E.

Journal:

The Journal of Chemical Physics

Year:

2003

Language:

english

File:

PDF, 339 KB

english, 2003

19

Nanosecond Dynamics and Structure of a Model DNA Triple Helix in Saltwater Solution

Weerasinghe, Samantha, Smith, Paul E., Mohan, V., Cheng, Y.-K., Pettitt, B. Montgomery

Journal:

Journal of the American Chemical Society

Year:

1995

Language:

english

File:

PDF, 1.85 MB

english, 1995

20

Structure and Dynamics of Collagen Hydration Water from Molecular Dynamics Simulations: Implications of Temperature and Pressure

Madhavi, Monika Monika, Weerasinghe, M. S. Samantha, Fullerton, Gary D., Momot, Konstantin I

Journal:

Journal of Physical Chemistry B

Year:

2019

Language:

english

File:

PDF, 3.01 MB

english, 2019

21

First Serological Study Revealing High Humoral Response and Evidence for Antigenic Heterogeneity in Leishmania donovani Induced CL in Sri Lanka

Deepachandi, Bhagya, Weerasinghe, Sudath, Ranasinghe, Samantha, Andrahennadi, Thisira P., Wickramanayake, Mahendra N., Siri, Shantha, Karunaweera, Nadira, Chandrasekharan, Vishvanath, Chatterjee, Mita

Journal:

BioMed Research International

Year:

2020

File:

PDF, 604 KB

2020

22

Structure and stability of a model pyrimidine-purine-purine DNA triple helix with a GC.cntdot.T mismatch by simulation

Weerasinghe, Samantha, Smith, Paul E., Pettitt, B. Montgomery

Journal:

Year:

1995

Language:

english

File:

PDF, 1.98 MB

english, 1995

23

Rotational Diffusion Propagator of the Intramolecular Proton-Proton Vector in Liquid Water: A Molecular Dynamics Study

Madhavi, Wisman Acharige Monika, Weerasinghe, M. S. Samantha, Momot, Konstantin I

Journal:

Journal of Physical Chemistry B

Year:

2017

Language:

english

File:

PDF, 1.84 MB

english, 2017

24

Plausible compounds drawn from plants as curative agents for neurodegeneration: An in-silico approach

Thiruchittampalam, Shalini, Weerasinghe, Samantha

Journal:

Journal of Computer-Aided Molecular Design

Year:

2020

File:

PDF, 1.18 MB

2020

25

Cracking a cancer code histone deacetylation in epigenetic: the implication from molecular dynamics simulations on efficacy assessment of histone deacetylase inhibitors

Dushanan, Ramachandren, Weerasinghe, Samantha, Dissanayake, Dhammike P., Senthilinithy, Rajendram

Journal:

Journal of Biomolecular Structure and Dynamics

Year:

2020

File:

PDF, 4.14 MB

2020

26

A Kirkwood–Buff derived force field for sodium chloride in water

Weerasinghe, Samantha, Smith, Paul E.

Journal:

The Journal of Chemical Physics

Year:

2003

Language:

english

File:

PDF, 392 KB

english, 2003

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