EconBiz - Find Economic Literature
    • Logout
    • Change account settings
  • A-Z
  • Beta
  • About EconBiz
  • News
  • Thesaurus (STW)
  • Academic Skills
  • Help
  •  My account 
    • Logout
    • Change account settings
  • Login
EconBiz - Find Economic Literature
Publications Events
Search options
Advanced Search history
My EconBiz
Favorites Loans Reservations Fines
    You are here:
  • Home
  • Search: subject:"Molecular Modeling"
Narrow search

Narrow search

Year of publication
Subject
All
Molecular modeling 3 Molecular Modeling 2 Multicanonical simulation 2 2D-Discrete Fourier Transform 1 Ball & Stick 1 Chagas Disease 1 Chemoface 1 CoMFA 1 EIS 1 Electrostatics 1 HQSAR 1 Helical structures 1 Integral 1 MIA-QSAR 1 Medicinal Chemistry 1 Multivariate Image 1 N80 steel 1 QSAR 1 Ramachandran plot 1 SEM 1 Special functions 1 Surfactant-like peptides 1 Van der Waals radii 1 Wireframes 1 hydrochloric acid 1 inhibition 1 molecular modeling 1 β-casein 1
more ... less ...
Online availability
All
Undetermined 6
Type of publication
All
Article 6
Language
All
Undetermined 4 English 2
Author
All
Andricopulo, Adriano D. 1 Arkın, Handan 1 Barigye, Stephen Jones 1 Ferreira, Leonardo G. 1 KUMAR, SUMIT 1 Köksel, H. 1 Puggina de Freitas, Matheus 1 SHARMA, DIPTI 1 YADAV, M. 1 YADAV, P. N. 1 Yaşar, F. 1 Yu, Yi-Kuo 1 de Souza, Anacleto S. 1 Çelik, S. 1
more ... less ...
Published in...
All
Physica A: Statistical Mechanics and its Applications 3 International Journal of Quantitative Structure-Property Relationships (IJQSPR) 2 Surface Review and Letters (SRL) 1
Source
All
RePEc 4 Other ZBW resources 2
Showing 1 - 6 of 6
Cover Image
2D and 3D QSAR Studies on a Series of Antichagasic Fenarimol Derivatives
de Souza, Anacleto S.; Ferreira, Leonardo G.; … - In: International Journal of Quantitative … 2 (2017) 1, pp. 44-63
Chagas disease is one of the most important neglected tropical diseases. Endemic in Latin America, the disease is a global public health problem, affecting several countries in North America, Europe, Asia and Oceania. The disease affects around 8-10 million people worldwide and the limited...
Persistent link: https://www.econbiz.de/10012047199
Saved in:
Cover Image
Ten Years of the MIA-QSAR Strategy: Historical Development and Applications
Barigye, Stephen Jones; Puggina de Freitas, Matheus - In: International Journal of Quantitative … 1 (2016) 1, pp. 64-77
It has been a decade since the introduction of the MIA-QSAR (acronym of Multivariate Image Analysis applied to Quantitative Structure Activity Relationship) method. While many successes have been achieved over the years, the path for the progressive development of this method has been far from...
Persistent link: https://www.econbiz.de/10012047189
Saved in:
Cover Image
EXPERIMENTAL AND QUANTUM STUDIES ON ADSORPTION AND CORROSION INHIBITION EFFECT OF IMIDAZOLE DERIVATIVES ON N80 STEEL IN HYDROCHLORIC ACID
YADAV, M.; KUMAR, SUMIT; SHARMA, DIPTI; YADAV, P. N. - In: Surface Review and Letters (SRL) 20 (2013) 06, pp. 1350057-1
The inhibition effect of synthesized N′-(phenylmethylidene)-2-(2-methyl-1H-benzimidazol-1-yl)acetohydrazides, N′-(4-methylphenylmethylidene)-2-(2-methyl-1H-benzimidazol-1-yl)acetohydrazides, and N′-(4-methoxyphenylmethylidene)-2-(2-methyl-1H-benzimidazol-1-yl)acetohydrazides on the...
Persistent link: https://www.econbiz.de/10011011136
Saved in:
Cover Image
Conformational properties of surfactant-like peptides with variable glycine tails
Arkın, Handan - In: Physica A: Statistical Mechanics and its Applications 389 (2010) 2, pp. 265-272
The three-dimensional structures of surfactant-like peptides containing 4–10 glycines as the components of the hydrophobic tails and aspartic acids as the hydrophilic heads (G4D2, G6D2, G8D2, G10D2) are investigated by using the multicanonical simulation procedure. The thermodynamically most...
Persistent link: https://www.econbiz.de/10011060321
Saved in:
Cover Image
The investigation of the secondary structures of various peptide sequences of β-casein by the multicanonical simulation method
Yaşar, F.; Çelik, S.; Köksel, H. - In: Physica A: Statistical Mechanics and its Applications 363 (2006) 2, pp. 348-358
-casein were studied by three-dimensional molecular modeling. In this work, the three-dimensional conformations of each peptide …
Persistent link: https://www.econbiz.de/10011061017
Saved in:
Cover Image
On a class of integrals of Legendre polynomials with complicated arguments—with applications in electrostatics and biomolecular modeling
Yu, Yi-Kuo - In: Physica A: Statistical Mechanics and its Applications 326 (2003) 3, pp. 522-533
The exact analytical result for a class of integrals involving (associated) Legendre polynomials of complicated argument is presented. The method employed can in principle be generalized to integrals involving other special functions. This class of integrals also proves useful in the...
Persistent link: https://www.econbiz.de/10011063952
Saved in:
A service of the
zbw
  • Sitemap
  • Plain language
  • Accessibility
  • Contact us
  • Imprint
  • Privacy

Loading...