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Viser treff 1-30 av 30

2017
1 Venkatraman, Vishwesh.
Equation Discovery with Genetic Programming. Virtual Simulation Lab; 2017-02-23 - 2017-02-23
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2 Venkatraman, Vishwesh; Alsberg, Bjørn Kåre.
Predicting CO2 capture of ionic liquids using machine learning. Journal of CO2 Utilization 2017 ;Volum 21. s. 162-168
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2016
3 Abburu, Sailesh; Venkatraman, Vishwesh; Alsberg, Bjørn Kåre.
TD-DFT based fine-tuning of molecular excitation energies using evolutionary algorithms. RSC Advances 2016 ;Volum 6. s. 3661-3670
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4 Venkatraman, Vishwesh; Alsberg, Bjørn Kåre.
KRAKENX: software for the generation of alignment-independent 3D descriptors. Journal of Molecular Modeling 2016 ;Volum 22.(4)
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5 Venkatraman, Vishwesh; Alsberg, Bjørn Kåre.
Quantitative structure-property relationship modelling of thermal decomposition temperatures of ionic liquids. Journal of Molecular Liquids 2016 ;Volum 223. s. 60-67
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6 Venkatraman, Vishwesh; Gupta, Mayuri; Foscato, Marco; Svendsen, Hallvard Fjøsne; Jensen, Vidar Remi; Alsberg, Bjørn Kåre.
Computer-aided molecular design of imidazole-based absorbents for CO2 capture. International Journal of Greenhouse Gas Control 2016 ;Volum 49. s. 55-63
NTNU UiB Untitled
 
2015
7 Alsberg, Bjørn Kåre; Venkatraman, Vishwesh.
Artificial evolution of coumarin dyes for dye sensitized solar cells. 1st International Solar Fuels Conference (ISF-1); 2015-04-26
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8 Bouza, Pablo Julian Murray; Venkatraman, Vishwesh; Alsberg, Bjørn Kåre.
Chirality sensitive and Aligment free Atoms-In-Molecules(AIM) descriptors. EUCO-CC 2015; 2015-08-31 - 2015-09-03
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9 Foscato, Marco; Occhipinti, Giovanni; Jensen, Vidar Remi; Venkatraman, Vishwesh; Alsberg, Bjørn Kåre.
Automated design of realistic organometallic complexes and catalysts. 249th ACS National Meeting & Exposition; 2015-03-22 - 2015-03-26
NTNU UiB Untitled
 
10 Venkatraman, Vishwesh; Abburu, Sailesh; Alsberg, Bjørn Kåre.
Artificial evolution of coumarin dyes for dye sensitized solar cells. Physical Chemistry, Chemical Physics - PCCP 2015 ;Volum 17.(41) s. 27672-27682
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11 Venkatraman, Vishwesh; Abburu, Sailesh; Alsberg, Bjørn Kåre.
Can chemometrics be used to guide the selection of suitable DFT functionals?. Chemometrics and Intelligent Laboratory Systems 2015 ;Volum 142. s. 87-94
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12 Venkatraman, Vishwesh; Alsberg, Bjørn Kåre.
A quantitative structure-property relationship study of the photovoltaic performance of phenothiazine dyes. Dyes and pigments 2015 ;Volum 114.(C) s. 69-77
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13 Venkatraman, Vishwesh; Foscato, Marco; Jensen, Vidar Remi; Alsberg, Bjørn Kåre.
Evolutionary de novo design of phenothiazine derivatives for dye-sensitized solar cells. Journal of Materials Chemistry A 2015 ;Volum 3.(18) s. 9851-9860
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14 Venkatraman, Vishwesh; Gupta, Mayuri; Foscato, Marco; Jensen, Vidar Remi; Svendsen, Hallvard Fjøsne; Alsberg, Bjørn Kåre.
Evolutionary de Novo Design of Absorbents for CO2 Capture. CLIMIT SUMMIT 2015; 2015-02-24 - 2015-02-25
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15 Venkatraman, Vishwesh; Gupta, Mayuri; Foscato, Marco; Jensen, Vidar Remi; Svendsen, Hallvard Fjøsne; Alsberg, Bjørn Kåre.
Evolutionary de novo design of absorbents for CO2 capture. International Symposium on Green Chemistry; 2015-05-03 - 2015-05-07
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16 Venkatraman, Vishwesh; Gupta, Mayuri; Foscato, Marco; Jensen, Vidar Remi; Svendsen, Hallvard Fjøsne; Alsberg, Bjørn Kåre.
Evolutionary de novo design of absorbents for CO2 capture. Trondheim Conference on CO2 Capture, Transport and Storage; 2015-06-16 - 2015-06-18
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2014
17 Abburu, Sailesh; Venkatraman, Vishwesh; Foscato, Marco; Jensen, Vidar Remi; Alsberg, Bjørn Kåre.
A de novo design approach to enhance the optical properties of azobenzenes. Swedish Theoretical Chemistry Meeting 2014; 2014-10-27 - 2014-10-29
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18 Alsberg, Bjørn Kåre; Venkatraman, Vishwesh; Gupta, Mayuri; Foscato, Marco; Svendsen, Hallvard Fjøsne; Jensen, Vidar Remi.
Evolutionary de novo design of absorbents for CO2 capture. Swedish Theoretical Chemistry Meeting 2014; 2014-10-27 - 2014-10-29
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19 Foscato, Marco; Occhipinti, Giovanni; Venkatraman, Vishwesh; Alsberg, Bjørn Kåre; Jensen, Vidar Remi.
Automated Design of Organometallic Compounds from 3D Fragments. 5th EuCheMS Chemistry Congress; 2014-08-31 - 2014-09-04
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20 Foscato, Marco; Occhipinti, Giovanni; Venkatraman, Vishwesh; Alsberg, Bjørn Kåre; Jensen, Vidar Remi.
Automated design of realistic organometallic molecules from fragments. Journal of Chemical Information and Modeling 2014 ;Volum 54.(3) s. 767-780
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21 Foscato, Marco; Occhipinti, Giovanni; Venkatraman, Vishwesh; Alsberg, Bjørn Kåre; Jensen, Vidar Remi.
Automated in Silico Design of Homogeneous Catalysts. 19th International Symposium on Homogeneous Catalysis; 2014-07-06 - 2014-07-11
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22 Foscato, Marco; Venkatraman, Vishwesh; Occhipinti, Giovanni; Alsberg, Bjørn Kåre; Jensen, Vidar Remi.
Automated building of organometallic complexes from 3D fragments. Journal of Chemical Information and Modeling 2014 ;Volum 54.(7) s. 1919-1931
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23 Venkatraman, Vishwesh; Åstrand, Per-Olof; Alsberg, Bjørn Kåre.
Quantitative structure-property relationship modeling of Grätzel solar cell dyes. Journal of Computational Chemistry 2014 ;Volum 35.(3) s. 214-226
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2013
24 Foscato, Marco; Occhipinti, Giovanni; Venkatraman, Vishwesh; Alsberg, Bjørn Kåre; Jensen, Vidar Remi.
Automatic building of transition metal compounds from fragments: a class-based approach. Very Accurate and Large Computations and Applications; 2013-06-09 - 2013-06-12
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25 Venkatraman, Vishwesh; Alsberg, Bjørn Kåre.
Modelling Quantitative Structure Property Relationships of Organic Dyes for Photovoltaic Solar Cells. Scandinavian Symposium on Chemometrics 13 (SSC13); 2013-06-17 - 2013-06-20
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26 Venkatraman, Vishwesh; Foscato, Marco; Occhipinti, Giovanni; Jensen, Vidar Remi; Alsberg, Bjørn Kåre.
QSPR-Guided de novo Design of Organic Photovoltaic Dyes. Scandinavian Symposium on Chemometrics 13 (SSC13); 2013-06-17 - 2013-06-20
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2012
27 Asses, Yasmine; Venkatraman, Vishwesh; Leroux, Vincent; Ritchie, David W.; Maigret, Bernard.
Exploring c-Met kinase flexibility by sampling and clustering its conformational space. Proteins: Structure, Function, and Genetics 2012 ;Volum 80.(4) s. 1227-1238
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28 Foscato, Marco; Ayala Ortega, Mauricio; Venkatraman, Vishwesh; Occhipinti, Giovanni; Jensen, Vidar Remi; Alsberg, Bjørn Kåre.
DENOPTIM: De novo OPTimization of Inorganic Molecules. The 11th Annual Meeting on High Performance Computing and Infrastructure for computational science in Norway; 2012-06-14 - 2012-06-15
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29 Ritchie, David W.; Ghoorah, AW; Mavridis, L; Venkatraman, Vishwesh.
Fast protein structure alignment using Gaussian overlap scoring of backbone peptide fragment similarity. Bioinformatics 2012 ;Volum 28.(24) s. 3274-3281
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30 Venkatraman, Vishwesh; Occhipinti, Giovanni; Foscato, Marco; Ayala Ortega, Mauricio; Jensen, Vidar Remi; Alsberg, Bjørn Kåre.
DENOPTIM: De novo OPTimization of Inorganic Molecules. The XXV International Conference on Organometallic Chemistry; 2012-09-02 - 2012-09-07
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