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Volume 34; Issue 3
Main
Molecular Simulation
Volume 34; Issue 3
Molecular Simulation
Volume 34; Issue 3
1
The phase diagram of the Lennard-Jones fluid using temperature dependent interaction parameters
Al-Matar, Ali Kh.
,
Tobgy, Ahmed H.
,
Suleiman, Ibrahim A.
Journal:
Molecular Simulation
Year:
2008
Language:
english
File:
PDF, 174 KB
Your tags:
english, 2008
2
Harvesting graphics power for MD simulations
van Meel, J.A.
,
Arnold, A.
,
Frenkel, D.
,
Portegies Zwart, S.F.
,
Belleman, R.G.
Journal:
Molecular Simulation
Year:
2008
Language:
english
File:
PDF, 244 KB
Your tags:
english, 2008
3
FT-IR, FT-Raman spectra and DFT vibrational analysis of 2-aminobiphenyl
Subramanian, M.K.
,
Anbarasan, P.M.
,
Ilangovan, V.
,
Sundaraganesan, N.
Journal:
Molecular Simulation
Year:
2008
Language:
english
File:
PDF, 316 KB
Your tags:
english, 2008
4
Thermal and pressure-induced martensitic phase transformations in a Ni–Al alloy modelled by Sutton–Chen embedded atom method
Kazanc, S.
,
Ozgen, S.
Journal:
Molecular Simulation
Year:
2008
Language:
english
File:
PDF, 948 KB
Your tags:
english, 2008
5
Refinement of comparative models of protein structure by using multicanonical molecular dynamics simulations
Ishitani, Ryuichiro
,
Terada, Tohru
,
Shimizu, Kentaro
Journal:
Molecular Simulation
Year:
2008
Language:
english
File:
PDF, 1.16 MB
Your tags:
english, 2008
6
Predicting rheology of suspensions of spherical and non-spherical particles using dissipative particle dynamics (DPD): methodology and experimental validation
Chatterjee, Athonu
,
Wu, Lung-Ming
Journal:
Molecular Simulation
Year:
2008
Language:
english
File:
PDF, 2.74 MB
Your tags:
english, 2008
7
Interaction between a twelve-residue segment of antifreeze protein type I, or its mutants, and water molecules
Nobekawa, Takashi
,
Taniguchi, Hiromi
,
Hagiwara, Yoshimichi
Journal:
Molecular Simulation
Year:
2008
Language:
english
File:
PDF, 3.67 MB
Your tags:
english, 2008
8
Fragment replica-exchange method for efficient protein conformation sampling
Suzuki, M.
,
Okuda, H.
Journal:
Molecular Simulation
Year:
2008
Language:
english
File:
PDF, 987 KB
Your tags:
english, 2008
9
Structure prediction and R115866 binding study of human CYP26A1: homology modelling, fold recognition, molecular docking and MD simulations
Ren, J.H.
,
Xiong, X.Q.
,
Sha, Y.
,
Yan, M.C.
,
Lin, B.
,
Wang, J.
,
Jing, Y.K.
,
Zhao, D.M.
,
Cheng, M.S.
Journal:
Molecular Simulation
Year:
2008
Language:
english
File:
PDF, 1.78 MB
Your tags:
english, 2008
10
Assessment of the convergence of molecular dynamics simulations of lipopolysaccharide membranes
Soares, T.A.
,
Straatsma, T.P.
Journal:
Molecular Simulation
Year:
2008
Language:
english
File:
PDF, 703 KB
Your tags:
english, 2008
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