books search
books
articles search
articles
Donate
Log In
Log In
to access more features
personal recommendations
Telegram Bot
download history
send to Email or Kindle
manage booklists
save to favorites
Explore
Journals
Contribution
Donate
Litera Library
Donate paper books
Add paper books
Open LITERA Point
Volume 38; Issue 1
Main
Molecular Simulation
Volume 38; Issue 1
Molecular Simulation
Volume 38; Issue 1
1
GPU-accelerated molecular dynamics simulation of solid covalent crystals
Hou, Chaofeng
,
Ge, Wei
Journal:
Molecular Simulation
Year:
2012
Language:
english
File:
PDF, 287 KB
Your tags:
english, 2012
2
Estimation of the free energy of hard-sphere crystals via a free-volume approach
Kwak, Sang Kyu
,
Park, Taezoon
,
Yoon, Yong-Jin
,
Lee, Jong-Min
Journal:
Molecular Simulation
Year:
2012
Language:
english
File:
PDF, 192 KB
Your tags:
english, 2012
3
Comparative parametric method 6 (PM6) and Recife model 1 (RM1) study of trans -stilbene
Camilo, A.
,
dos Santos, R. P.B.
,
Coluci, V. R.
,
Galvão, D. S.
Journal:
Molecular Simulation
Year:
2012
Language:
english
File:
PDF, 164 KB
Your tags:
english, 2012
4
Quantitative structure–activity relationship study on antitumour activity of a series of flavonoids
Wang, Wei-Xuan
,
Si, Hongzong
,
Zhang, Ziding
Journal:
Molecular Simulation
Year:
2012
Language:
english
File:
PDF, 141 KB
Your tags:
english, 2012
5
Competition between hydrogen bonding and electric field in single-file transport of water in carbon nanotubes
Figueras, Luis
,
Faraudo, Jordi
Journal:
Molecular Simulation
Year:
2012
Language:
english
File:
PDF, 173 KB
Your tags:
english, 2012
6
Enhanced selectivity and capacity of adsorption of CO 2 and CH 4 in zeolite-like metal-organic frameworks with different extra-framework cations: a molecular simulation study
He, Peng
,
Liu, Hui
,
Li, Yanfeng
,
Lei, Zhigang
,
Huang, Shiping
,
Wang, Peng
,
Tian, Huiping
Journal:
Molecular Simulation
Year:
2012
Language:
english
File:
PDF, 767 KB
Your tags:
english, 2012
7
Mathematical modelling and computer simulation of Brownian motion and hybridisation of nanoparticle–bioprobe–polymer complexes in the low concentration limit
Tóth, Árpád
,
Bánky, Dániel
,
Grolmusz, Vince
Journal:
Molecular Simulation
Year:
2012
Language:
english
File:
PDF, 214 KB
Your tags:
english, 2012
8
A theoretical extension for the electrical conductivity of molten salts
Kusakabe, Masanobu
,
Takeno, Shigeharu
,
Koishi, Takahiro
,
Matsunaga, Shigeki
,
Tamaki, Shigeru
Journal:
Molecular Simulation
Year:
2012
Language:
english
File:
PDF, 208 KB
Your tags:
english, 2012
9
Effects of ions on winter flounder antifreeze protein and water molecules near an ice/water interface
Hayakari, Kohei
,
Hagiwara, Yoshimichi
Journal:
Molecular Simulation
Year:
2012
Language:
english
File:
PDF, 1.13 MB
Your tags:
english, 2012
10
Excited-state hydrogen-bonding dynamics of trans -acetanilide in an aqueous environment: a theoretical study
Zhang, Xiaoyu
,
Zhang, Weiping
Journal:
Molecular Simulation
Year:
2012
Language:
english
File:
PDF, 255 KB
Your tags:
english, 2012
1
Follow
this link
or find "@BotFather" bot on Telegram
2
Send /newbot command
3
Specify a name for your chatbot
4
Choose a username for the bot
5
Copy an entire last message from BotFather and paste it here
×
×
