[HTML][HTML] Effect of organic solvents on microalgae growth, metabolism and industrial bioproduct extraction: a review
In this review, the effect of organic solvents on microalgae cultures from molecular to
industrial scale is presented. Traditional organic solvents and solvents of new generation …
industrial scale is presented. Traditional organic solvents and solvents of new generation …
Comparison of deep learning with multiple machine learning methods and metrics using diverse drug discovery data sets
Machine learning methods have been applied to many data sets in pharmaceutical research
for several decades. The relative ease and availability of fingerprint type molecular …
for several decades. The relative ease and availability of fingerprint type molecular …
Toxicity of 13 different antibiotics towards freshwater green algae Pseudokirchneriella subcapitata and their modes of action
L Fu, T Huang, S Wang, X Wang, L Su, C Li, Y Zhao - Chemosphere, 2017 - Elsevier
Although modes of action (MOAs) play a key role in the understanding of the toxic
mechanism of chemicals, the MOAs have not been investigated for antibiotics to green …
mechanism of chemicals, the MOAs have not been investigated for antibiotics to green …
Synthesis and characterization of polyethylene terephthalate (PET) precursors and potential degradation products: Toxicity study and application in discovery of novel …
M Djapovic, D Milivojevic, T Ilic-Tomic, M Lješević… - Chemosphere, 2021 - Elsevier
Polyethylene terephthalate (PET) is widely used material and as such became highly
enriched in nature. It is generally considered inert and safe plastic, but due to the recent …
enriched in nature. It is generally considered inert and safe plastic, but due to the recent …
Can toxicity for different species be correlated?: the concept and emerging applications of interspecies quantitative structure-toxicity relationship (i-QSTR) modeling
Experimental evaluation of the toxicity of a compound is an expensive practice, and it
requires sacrifice of a large number of animals. As a consequence, in silico techniques for …
requires sacrifice of a large number of animals. As a consequence, in silico techniques for …
Open source Bayesian models. 1. Application to ADME/Tox and drug discovery datasets
On the order of hundreds of absorption, distribution, metabolism, excretion, and toxicity
(ADME/Tox) models have been described in the literature in the past decade which are …
(ADME/Tox) models have been described in the literature in the past decade which are …
Bioelectrochemical approach for reductive and oxidative dechlorination of chlorinated aliphatic hydrocarbons (CAHs)
A Lai, F Aulenta, M Mingazzini, MT Palumbo… - Chemosphere, 2017 - Elsevier
A sequential reductive-oxidative treatment was developed in this study in a continuous-flow
bioelectrochemical reactor to address bioremediation of groundwater contaminated by …
bioelectrochemical reactor to address bioremediation of groundwater contaminated by …
Open source Bayesian models. 2. Mining a “big dataset” to create and validate models with ChEMBL
In an associated paper, we have described a reference implementation of Laplacian-
corrected naïve Bayesian model building using extended connectivity (ECFP)-and …
corrected naïve Bayesian model building using extended connectivity (ECFP)-and …
Physico-chemical properties and toxicity of alkylated polycyclic aromatic hydrocarbons
HJ Kang, SY Lee, JH Kwon - Journal of Hazardous Materials, 2016 - Elsevier
Crude oil and refined petroleum products contain many polycyclic and heterocyclic aromatic
hydrocarbons, in particular, alkylated PAHs. Although alkylated PAHs are found in …
hydrocarbons, in particular, alkylated PAHs. Although alkylated PAHs are found in …
Consensus QSAR models estimating acute toxicity to aquatic organisms from different trophic levels: algae, Daphnia and fish
F Lunghini, G Marcou, P Azam, MH Enrici… - SAR and QSAR in …, 2020 - Taylor & Francis
We report new consensus models estimating acute toxicity for algae, Daphnia and fish
endpoints. We assembled a large collection of 3680 public unique compounds annotated …
endpoints. We assembled a large collection of 3680 public unique compounds annotated …