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1

Prediction of Density and Viscosity of Biofuel Compounds Using Machine Learning Methods

Saldana, Diego Alonso, Starck, Laurie, Mougin, Pascal, Rousseau, Bernard, Ferrando, Nicolas, Creton, Benoit

Journal:

Year:

2012

Language:

english

File:

PDF, 1.55 MB

english, 2012

2

Flash Point and Cetane Number Predictions for Fuel Compounds Using Quantitative Structure Property Relationship (QSPR) Methods

Saldana, Diego Alonso, Starck, Laurie, Mougin, Pascal, Rousseau, Bernard, Pidol, Ludivine, Jeuland, Nicolas, Creton, Benoit

Journal:

Year:

2011

Language:

english

File:

PDF, 1.86 MB

english, 2011

3

GC-PPC-SAFT Equation of State for VLE and LLE of Hydrocarbons and Oxygenated Compounds. Sensitivity Analysis

Nguyen, Thanh-Binh, de Hemptinne, Jean-Charles, Creton, Benoit, Kontogeorgis, Georgios M.

Journal:

Industrial & Engineering Chemistry Research

Year:

2013

Language:

english

File:

PDF, 1.02 MB

english, 2013

4

Prediction of the Cetane Number of Diesel Compounds Using the Quantitative Structure Property Relationship

Creton, Benoit, Dartiguelongue, Cyril, de Bruin, Theodorus, Toulhoat, Hervé

Journal:

Year:

2010

Language:

english

File:

PDF, 1.21 MB

english, 2010

5

Surface Photografting of Acrylic Acid on Poly(dimethylsiloxane). Experimental and Dissipative Particle Dynamics Studies

Ramírez-Gutiérrez, David, Nieto-Draghi, Carlos, Pannacci, Nicolas, Castro, Laura V., Álvarez-Ramírez, Fernando, Creton, Benoit

Journal:

Year:

2015

Language:

english

File:

PDF, 5.10 MB

english, 2015

6

A General Guidebook for the Theoretical Prediction of Physicochemical Properties of Chemicals for Regulatory Purposes

Nieto-Draghi, Carlos, Fayet, Guillaume, Creton, Benoit, Rozanska, Xavier, Rotureau, Patricia, de Hemptinne, Jean-Charles, Ungerer, Philippe, Rousseau, Bernard, Adamo, Carlo

Journal:

Chemical Reviews

Year:

2015

Language:

english

File:

PDF, 9.05 MB

english, 2015

7

Equivalent alkane carbon number of crude oils: A predictive model based on machine learning

Creton, Benoit, Lévêque, Isabelle, Oukhemanou, Fanny

Journal:

Oil & Gas Science and Technology – Revue d'IFP Energies nouvelles

Year:

2019

Language:

english

File:

PDF, 577 KB

english, 2019

8

Inverse‐QSPR for de novo design: a review

Gantzer, Philippe, CRETON, Benoît, Nieto-Draghi, Carlos

Journal:

Molecular Informatics

Year:

2019

Language:

english

File:

PDF, 1.25 MB

english, 2019

9

Inverse‐QSPR for de novo design: a review

Gantzer, Philippe, CRETON, Benoît, Nieto-Draghi, Carlos

Journal:

Molecular Informatics

Year:

2019

File:

PDF, 1.25 MB

2019

10

Effect of Live-Crude-Oil Composition on Optimal Salinity of a Surfactant Formulation: Experiments and Modeling

Marliere, Claire, Creton, Benoit

Journal:

SPE Reservoir Evaluation & Engineering

Year:

2019

File:

PDF, 863 KB

2019

11

Thermodynamic study of binary systems containing sulphur dioxide: Measurements and molecular modelling

Elise El Ahmar, Benoit Creton, Alain Valtz, Christophe Coquelet, Véronique Lachet, Dominique Richon, Philippe Ungerer

Journal:

Fluid Phase Equilibria

Year:

2011

Language:

english

File:

PDF, 506 KB

english, 2011

12

Electron Counting in Carbaalane Clusters with Cubic Aluminum Core

Benoit Creton, Samia Kahlal, Maria Teresa Garland, Zhenyang Lin, Jean-François Halet, Jean-Yves Saillard

Journal:

Journal of Cluster Science

Year:

2007

Language:

english

File:

PDF, 433 KB

english, 2007

13

Molecular Dynamics Study of Hydrated Imogolite. 1. Vibrational Dynamics of the Nanotube

Creton, Benoît, Bougeard, Daniel, Smirnov, Konstantin S., Guilment, Jean, Poncelet, Olivier

Journal:

The Journal of Physical Chemistry C

Year:

2008

Language:

english

File:

PDF, 597 KB

english, 2008

14

Molecular dynamics study of hydrated imogolite : 2. Structure and dynamics of confined water

Creton, Benoît, Bougeard, Daniel, Smirnov, Konstantin S., Guilment, Jean, Poncelet, Olivier

Journal:

Physical Chemistry Chemical Physics

Year:

2008

Language:

english

File:

PDF, 2.04 MB

english, 2008

15

Prediction of Flash Points for Fuel Mixtures Using Machine Learning and a Novel Equation

Saldana, Diego Alonso, Starck, Laurie, Mougin, Pascal, Rousseau, Bernard, Creton, Benoit

Journal:

Year:

2013

Language:

english

File:

PDF, 834 KB

english, 2013

16

Impact of functionalized linkers on the energy landscape of ZIFs

Galvelis, Raimondas, Slater, Ben, Chaudret, Robin, Creton, Benoit, Nieto-Draghi, Carlos, Mellot-Draznieks, Caroline

Journal:

Year:

2013

Language:

english

File:

PDF, 2.17 MB

english, 2013

17

Prediction of thermodynamic properties of adsorbed gases in zeolitic imidazolate frameworks

Amrouche, Hedi, Creton, Benoit, Siperstein, Flor, Nieto-Draghi, Carlos

Journal:

Year:

2012

Language:

english

File:

PDF, 809 KB

english, 2012

18

Impact of Associated Gases on Equilibrium and Transport Properties of a(mathrm{CO}_{2})Stream: Molecular Simulation and Experimental Studies

Creton, Benoit, de Bruin, Theodorus, Le Roux, Dominique, Duchet-Suchaux, Pierre, Lachet, Véronique

Journal:

International Journal of Thermophysics

Year:

2014

Language:

english

File:

PDF, 691 KB

english, 2014

19

Improving GC-PPC-SAFT equation of state for LLE of hydrocarbons and oxygenated compounds with water

Nguyen, Thanh-Binh, de Hemptinne, Jean-Charles, Creton, Benoit, Kontogeorgis, Georgios M.

Journal:

Fluid Phase Equilibria

Year:

2014

Language:

english

File:

PDF, 2.00 MB

english, 2014

20

Extension of a Charged Anisotropic United Atoms Model to Polycyclic Aromatic Compounds

Creton, Benoit, de Bruin, Theodorus, Lachet, Véronique, Nieto-Draghi, Carlos

Journal:

Journal of Physical Chemistry B

Year:

2010

Language:

english

File:

PDF, 1.75 MB

english, 2010

21

Composition Analysis and Viscosity Prediction of Complex Fuel Mixtures Using a Molecular-Based Approach

Aquing, Michelle, Ciotta, Fausto, Creton, Benoit, Féjean, Christophe, Pina, Annabelle, Dartiguelongue, Cyril, Trusler, J. P. Martin, Vignais, Romain, Lugo, Rafael, Ungerer, Philippe, Nieto-Draghi, Car

Journal:

Year:

2012

Language:

english

File:

PDF, 1.79 MB

english, 2012

22

Optimisation of the dynamical behaviour of the anisotropic united atom model of branched alkanes: application to the molecular simulation of fuel gasoline

Nieto-Draghi, Carlos, Bocahut, Anthony, Creton, Benoît, Have, Pascal, Ghoufi, Aziz, Wender, Aurélie, Boutin, Anne, Rousseau, Bernard, Normand, Laurent

Journal:

Molecular Simulation

Year:

2008

Language:

english

File:

PDF, 624 KB

english, 2008

23

Prediction of Optimal Salinities for Surfactant Formulations Using a Quantitative Structure–Property Relationships Approach

Muller, Christophe, Maldonado, Ana G., Varnek, Alexandre, Creton, Benoit

Journal:

Year:

2015

Language:

english

File:

PDF, 738 KB

english, 2015

24

Prediction of Alternative Gasoline Sorption in a Semicrystalline Poly(ethylene)

Villanueva, Nicolas, Flaconnèche, Bruno, Creton, Benoit

Journal:

ACS Combinatorial Science

Year:

2015

Language:

english

File:

PDF, 1.39 MB

english, 2015

25

Characterization Scheme for Property Prediction of Fluid Fractions Originating from Biomass

Nguyen, Thanh-Binh, de Hemptinne, Jean-Charles, Creton, Benoit, Kontogeorgis, Georgios M.

Journal:

Year:

2015

Language:

english

File:

PDF, 1.34 MB

english, 2015

26

[Society of Petroleum Engineers SPE EOR Conference at Oil and Gas West Asia - Muscat, Oman (2016-03-21)] SPE EOR Conference at Oil and Gas West Asia - Impact of Live Crude Oil Composition On Optimal Salinity of A Surfactant Formulation

Marliere, Claire, Creton, Benoit, Oukhemanou, Fanny, Wartenberg, Nicolas, Courtaud, Tiphaine, Féjean, Christophe, Betoulle, Stéphane, Defiolle, Denis, Mougin, Pascal

Language:

english

File:

PDF, 1.90 MB

english

27

[Society of Petroleum Engineers SPE International Symposium on Oilfield Chemistry - The Woodlands, Texas, USA (2013-04-08)] SPE International Symposium on Oilfield Chemistry - Application of Quantitative Structure-Property Relationship (QSPR) Method for Chemical EOR Surfactant Selection

Moreau, Patrick, Maldonado, Ana, Oukhemanou, Fanny, Creton, Benoit

Language:

english

File:

PDF, 477 KB

english

28

Thermodynamic study of binary systems containing sulphur dioxide and nitric oxide: Measurements and modelling

Creton, Benoit, Nieto-Draghi, Carlos, de Bruin, Theodorus, Lachet, Véronique, El Ahmar, Elise, Valtz, Alain, Coquelet, Christophe, Lasala, Silvia, Privat, Romain, Jaubert, Jean-Noël

Journal:

Fluid Phase Equilibria

Year:

2017

Language:

english

File:

PDF, 7.05 MB

english, 2017

29

Simulations of interfacial tension of liquid-liquid ternary mixtures using optimized parameterization for coarse-grained models

Steinmetz, David, Creton, Benoit, Lachet, Veronique, Rousseau, Bernard, Nieto-Draghi, Carlos

Journal:

Journal of Chemical Theory and Computation

Year:

2018

Language:

english

File:

PDF, 2.60 MB

english, 2018

30

Equivalent Alkane Carbon Number of Live Crude Oil: A Predictive Model Based on Thermodynamics

Creton, Benoit, Mougin, Pascal

Journal:

Oil & Gas Science and Technology – Revue d'IFP Energies nouvelles

Year:

2016

File:

PDF, 323 KB

2016

31

Effect of Live-Crude-Oil Composition on Optimal Salinity of a Surfactant Formulation: Experiments and Modeling

Marliere, Claire, Creton, Benoit

Journal:

SPE Reservoir Evaluation & Engineering

Year:

2019

Language:

english

File:

PDF, 863 KB

english, 2019

32

Erratum to: Equivalent alkane carbon number of crude oils: A predictive model based on machine learning

Creton, Benoit, LÃ©vÃªque, Isabelle, Oukhemanou, Fanny

Journal:

Oil & Gas Science and Technology – Revue d'IFP Energies nouvelles

Year:

2019

File:

PDF, 40 KB

2019