Results 171 to 180 of about 26,718 (332)

Machine Learning-Guided Prediction of Formulation Performance in Inhalable Ciprofloxacin-Bile Acid Dispersions with Antimicrobial and Toxicity Evaluation. [PDF]

Mol Pharm
Bahjat TZ, Mohammed M Ways T, Aziz SA, Ibrahim AI, Danto D, Ghattas V, Raouf GM, Barrett G, Sabir DK, Mohamedsalih PM, Al-Obaidi H.   +10 more
europepmc   +1 more source

AutoVap: An Interactive Machine Learning Tool for Predicting the Standard Enthalpy of Vaporization

Chemie Ingenieur Technik, EarlyView.
AutoVap (https://autovap.jfcaetano.com) is a web app that predicts ΔvapHm° from SMILES using an RDKit‐based ML model, giving accurate, interpretable results with uncertainty across diverse molecules. ABSTRACT This communication introduces AutoVap (https://autovap.jfcaetano.com), an interactive web application for predicting the standard molar enthalpy ...
José Ferraz‐Caetano
wiley   +1 more source

Multi criterion decision making analysis of hematologic cancer drugs via topological indices and physicochemical properties. [PDF]

Sci Rep
Huang L, Hanif S, Siddiqui MK, Hanif MF, Hanif MF, Fiidow MA.   +5 more
europepmc   +1 more source

Optimal model‐based design of experiments for parameter precision: Supercritical extraction case

The Canadian Journal of Chemical Engineering, EarlyView.
Abstract This study investigates the process of chamomile oil extraction from flowers. A parameter‐distributed model consisting of a set of partial differential equations is used to describe the governing mass transfer phenomena in a cylindrical packed bed with solid chamomile particles under supercritical conditions using carbon dioxide as a solvent ...
Oliwer Sliczniuk, Pekka Oinas
wiley   +1 more source

Continuous tuning of ejector parameters via zeotropic component migration for optimising high-temperature heat pump. [PDF]

Commun Eng
Li Z, Liang Y, Zhu Y, Yao S, Yu Z.
europepmc   +1 more source

A‐optimal model‐based design of experiments for processes with uncertain inputs

The Canadian Journal of Chemical Engineering, EarlyView.
Abstract Model‐based design of experiments (MBDoE) techniques are tools for selecting experimental conditions that enable accurate parameter estimation for mechanistic models. Most MBDoE approaches assume that the selected experimental conditions will be implemented perfectly, without uncertainties in the independent variables.
Bright Ofori, Iman Moshiritabrizi, Anh‐Duong Vo, Kimberley B. McAuley   +3 more
wiley   +1 more source

A QSPR study of coronary artery disease drugs using eccentricity-based indices. [PDF]

Sci Rep
Iqbal N, Akhter S, Alraih AM, Iqbal Z, Aslam A, Tola KA.   +5 more
europepmc   +1 more source

Enthalpies of Vaporization of Organic Compounds. III. Amines. [PDF]

Acta Chemica Scandinavica, 1969
Ingemar Wadsö, Jussi Heikkilä, B. Beagley, Tarja Aalto, Per-Erik Werner, Ulf Junggren, Bo Lamm, Benny Samuelsson   +7 more
openaire   +1 more source

Clathrate hydrate crystallization

The Canadian Journal of Chemical Engineering, EarlyView.
Abstract Clathrate hydrate crystallization has been an area of interest to chemical engineers from the point of view of crystal structure, thermophysical properties, phase equilibria, kinetics, industrial applications, and environmental (climate change) implications.
Peter Englezos
wiley   +1 more source

1-Ethyl-4-butyl-1,2,4-triazolium acetyl amino acid ionic liquids: preparation and characterization of physicochemical properties. [PDF]

RSC Adv
Liang K, Meng J, Qiao J, Liang L, Fang D, Yao H.   +5 more
europepmc   +1 more source