Volume 29, Issue 3 | Journal of Computer-Aided Molecular Design

Journal of Computer-Aided Molecular Design

Incorporating Perspectives in Drug Discovery and Design

Publishing model:: Hybrid

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Volume 29, Issue 3

March 2015

Including an Article of the Special Series: Statistics in Molecular Modeling

Issue Editor:

Anthony Nicholls

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7 articles in this issue

Benefits of statistical molecular design, covariance analysis, and reference models in QSAR: a case study on acetylcholinesterase
C. David Andersson
J. Mikael Hillgren
Anna Linusson
Special Series: Statistics in Molecular Modeling Open access 29 October 2014 Pages: 199 - 215
Performance of the SMD and SM8 models for predicting solvation free energy of neutral solutes in methanol, dimethyl sulfoxide and acetonitrile
Caroline C. Zanith
Josefredo R. Pliego Jr.
OriginalPaper 15 November 2014 Pages: 217 - 224
Markov model-based polymer assembly from force field-parameterized building blocks
Vedat Durmaz
OriginalPaper 27 November 2014 Pages: 225 - 232
Continuous indicator fields: a novel universal type of molecular fields
Gleb V. Sitnikov
Nelly I. Zhokhova
Igor I. Baskin
OriginalPaper 02 December 2014 Pages: 233 - 247
Rational design of biaryl pharmacophore inserted noscapine derivatives as potent tubulin binding anticancer agents
Seneha Santoshi
Naresh Kumar Manchukonda
Pradeep Kumar Naik
OriginalPaper 07 December 2014 Pages: 249 - 270
Insights into the preferential order of strand exchange in the Cre/loxP recombinase system: impact of the DNA spacer flanking sequence and flexibility
Josephine Abi-Ghanem
Sergey A. Samsonov
M. Teresa Pisabarro
OriginalPaper 03 January 2015 Pages: 271 - 282
Role of indirect readout mechanism in TATA box binding protein–DNA interaction
Manas Mondal
Devapriya Choudhury
Dhananjay Bhattacharyya
OriginalPaper 10 January 2015 Pages: 283 - 295