Alfonso Fernández-González

Prediction of pregnancy viability in bovine in vitro-produced embryos and recipient plasma with Fourier transform infrared spectroscopy

We analyzed embryo culture medium (CM) and recipient blood plasma using Fourier transform infrared (FTIR) metabolomics to predict pregnancy outcome. Individually cultured, in vitro-produced (IVP) blastocysts were transferred to recipients as fresh and vitrified-warmed. Spent CM and plasma samples were evaluated using FTIR. The discrimination capability of the classifiers was assessed for accuracy, sensitivity (pregnancy), specificity (nonpregnancy), and area under the receiver operator characteristic curve (AUC). Within all IVP fresh embryos (birth rate=52%), high AUC were obtained at birth, especially with expanded blastocysts (CM: 0.80±0.053; plasma: 0.89±0.034). The AUC of vitrified IVP embryos (birth rate = 31%) were 0.607±0.038 (CM, expanded blastocysts) and 0.672±0.023 (plasma, all stages). Recipient plasma generally predicted pregnancy outcome better than did embryo CM. Embryos and recipients with improved pregnancy viability were identified, which could increase the economic benefit to the breeding industry.

Comparative study of the micellar enhanced spectrophotometric determination of β-lactamic antibiotics by batch and flow injection analysis using a multisimplex design

A study has been made on the spectrophotometric determination of the beta-lactamic antibiotics, amoxicillin and ampicillin, in micellar media using Cu ions as catalyst. Batch and flow injection approaches were compared. Multisimplex design was used to determine the optimal values of the flow injection analysis (FIA) system. Chemical (buffer, pH and Cu(II) concentrations) and physical (flow rate, temperature and reaction coil length) variables were considered. The analytical performance characteristics were as follows: the detection limits for batch and flow-through systems were 2.5 x 10(-7) and 2 x 10(-6) M, respectively, and a relative standard deviation less than 1% was found for both methods. The proposed FIA methodology was satisfactorily applied to the determination of the antibiotics in pharmaceutical formulations.

Metabolomic Prediction of Pregnancy Viability in Superovulated Cattle Embryos and Recipients with Fourier Transform Infrared Spectroscopy

We analyzed embryo culture medium (CM) and recipient blood plasma using Fourier transform infrared spectroscopy (FTIR) metabolomics to identify spectral models predictive of pregnancy outcome. Embryos collected on Day 6 from superovulated cows in 2 countries were individually cultured in synthetic oviduct fluid medium with BSA for 24 h before embryo transfer. Spent CM, blank controls, and plasma samples (Day 0 and Day 7) were evaluated using FTIR. The spectra obtained were analyzed. The discrimination capability of the classifiers was assessed for accuracy, sensitivity (pregnancy), specificity (nonpregnancy), and area under the ROC curve (AUC). Endpoints considered were Day 60 pregnancy and birth. High AUC was obtained for Day 60 pregnancy in CM within individual laboratories (France AUC = 0.751 ± 0.039, Spain AUC = 0.718 ± 0.024), while cumulative data decreased the AUC (AUC = 0.604  ±  0.029). Predictions for CM at birth were lower than Day 60 pregnancy. Predictions with plasma at birth improved cumulative over individual results (Day 0: France AUC = 0.690 ± 0.044; Spain AUC < 0.55; cumulative AUC = 0.747 ± 0.032). Plasma generally predicted pregnancy and birth better than CM. These first results show that FTIR metabolomics could allow the identification of embryos and recipients with improved pregnancy viability, which may contribute to increasing the efficiency of selection schemes based on ET.

The Triplet State: Emerging Applications of Room Temperature Phosphorescence Spectroscopy

Abstract Room‐temperature phosphorescence (RTP) has been exploited for analytical research for over 30 years now due to the widespread recognition of its unique properties as a selective and sensitive technique, complementary to fluorescence. Recent years have seen the awakening of medical, geological, industrial, and technological interest in its application. The trend continues, driven by the achievements that have already been made and the promise of future achievements. This review attempts to cover specifically emerging applications of RTP in areas such as medicine, geological dating, forensics, and technology, illustrating the advantages that can be derived from the use of the technique and stressing its potential for novel applications.

Natural Logarithm Derivative Method: A novel and easy methodology for finding maximums in overlapping experimental peaks

The method of the First Derivative usually fails to detect overlapped peaks, especially when they appear as shoulders of the main one. Furthermore, the determination of the position of the maximum with this method is based on a single point, and it is highly dependent of the noise level of the experimental data. In this work, we propose an easy method to accurately estimate peak positions, based on a linearization of Gaussian curves. The method, which we called Natural Logarithm Derivative Method (NLDM), is also able to detect to a certain extent overlapping peaks, even when appearing as shoulders. Several factors such as the Lorentzian influence in the peak shape, the experimental error in the numerical calculations, or the minimum separation between peaks in order to be properly resolved are studied. The method is assayed with real samples, demonstrating the possibility of finding overlapping peaks in dyes, and in mixtures of dyes.

Structures of relevant ammonium salts in fertilizers

The crystal structures of two double salts of ammonium nitrate (AN) and ammonium sulfate (AS) are reported. The double salts 2NH(4)NO(3).(NH(4))(2)SO(4) (2AN.AS) and 3NH(4)NO(3).(NH(4))(2)SO(4) (3AN.AS) show a very similar crystal structure packing with alternating layers of anions and cations. The solid-state ionic distribution is controlled by an extensive hydrogen-bonding network with ammonium groups as the donors and O atoms acting as the acceptors. Crystallographic studies were conducted at both room temperature (293 K) and 100 K. Increasing the temperature involves shortening the b axis in the case of the 3AN.AS salt. Quantification of fertilizer mixtures using the Rietveld method was also carried out by means of the structural models reported in this paper for both salts.