| Publication |
Sentence |
Publish Date |
Extraction Date |
Species |
| Stephen J Cotto. A truncated Davidson method for the efficient "chemically accurate" calculation of full configuration interaction wavefunctions without any large matrix diagonalization. The Journal of chemical physics. vol 157. issue 22. 2022-12-22. PMID:36546794. |
this work develops and illustrates a new method of calculating "chemically accurate" electronic wavefunctions (and energies) via a truncated full configuration interaction (ci) procedure, which arguably circumvents the large matrix diagonalization that is the core problem of full ci and is also central to modern selective ci approaches. |
2022-12-22 |
2023-08-14 |
Not clear |
| Changhun Kim, Jaeseong Jeong, Jinhee Cho. Effects of Class Imbalance and Data Scarcity on the Performance of Binary Classification Machine Learning Models Developed Based on ToxCast/Tox21 Assay Data. Chemical research in toxicology. vol 35. issue 12. 2022-12-19. PMID:36475638. |
an assay matrix based on ci and ds was prepared for 335 assays with biologically intended target information, and 28 ci assays and 3 ds assays were selected. |
2022-12-19 |
2023-08-14 |
Not clear |
| Shunyue Yuan, Yueqing Chang, Lucas K Wagne. Quantification of electron correlation for approximate quantum calculations. The Journal of chemical physics. vol 157. issue 19. 2022-11-22. PMID:36414457. |
in this work, we assess the von neumann entropy of the one-particle reduced density matrix (1-rdm) to compare selected configuration interaction (ci), coupled cluster, variational monte carlo, and fixed-node diffusion monte carlo for benchmark hydrogen chains. |
2022-11-22 |
2023-08-14 |
Not clear |
| Samuel M Greene, Robert J Webber, James E T Smith, Jonathan Weare, Timothy C Berkelbac. Full Configuration Interaction Excited-State Energies in Large Active Spaces from Subspace Iteration with Repeated Random Sparsification. Journal of chemical theory and computation. 2022-11-08. PMID:36345915. |
in the majority of these test cases, our approach yields total excited-state energies that agree with those from state-of-the-art methods─including heat-bath ci, the density matrix renormalization group approach, and fciqmc─to within sub-millihartree accuracy. |
2022-11-08 |
2023-08-14 |
Not clear |
| Chingching Foocharoen, Wilaiphorn Thinkhamrop, Nathaphop Chaichaya, Ajanee Mahakkanukrauh, Siraphop Suwannaroj, Bandit Thinkhamro. Development and validation of machine learning for early mortality in systemic sclerosis. Scientific reports. vol 12. issue 1. 2022-10-13. PMID:36229500. |
in addition, the model's performance was evaluated using the area under the receiver operating characteristic curve (auroc) and its 95% confidence interval (ci) and values in the confusion matrix. |
2022-10-13 |
2023-08-14 |
Not clear |
| Jaber Yaghini, Ahmad Mogharehabed, Awat Feizi, Zohreh Afshar. Efficacy of acellular dermal matrix in soft tissue augmentation around dental implants: A systematic review and meta-analysis. The Journal of oral implantology. 2022-07-26. PMID:35881814. |
based on the meta-analysis of 6 studies, the effect of acellular dermal matrix on stt and kmw was significant (wmd: 1.07 (95%ci: 0.34, 1.79) p=0.004, and wmd: 1.99 (95%ci: 0.88, 3.09), p<0.001, respectively). |
2022-07-26 |
2023-08-14 |
Not clear |
| Jaber Yaghini, Ahmad Mogharehabed, Awat Feizi, Zohreh Afshar. Efficacy of acellular dermal matrix in soft tissue augmentation around dental implants: A systematic review and meta-analysis. The Journal of oral implantology. 2022-07-26. PMID:35881814. |
further, a comparison between the efficacy of the acellular dermal matrix and the control group, which included the autogenous soft tissue augmentation techniques, showed no statistically significant differences between groups (stt: wmd: 0.24 (95%ci: -0.26, 0.74) p=0.161 and kmw: wmd: -0.23 (95%ci: -0.68, 0.22), p=0.324). |
2022-07-26 |
2023-08-14 |
Not clear |
| A Munteanu, A Ronzova, E Kutalkova, P Drohsler, R Moucka, M Kracalik, O Bilek, S A Mazlan, M Sedlaci. Reprocessed magnetorheological elastomers with reduced carbon footprint and their piezoresistive properties. Scientific reports. vol 12. issue 1. 2022-07-14. PMID:35835843. |
these changes are attributed to the intermolecular bonding between the hydroxyl groups on the surface of the ci particles and the matrix which is studied in depth. |
2022-07-14 |
2023-08-14 |
Not clear |
| Anjaneyulu Murari, Naga S V Goparaju, Shauna-Kay Rhooms, Kaniz F B Hossain, Felix G Liang, Christian J Garcia, Cindy Osei, Tong Liu, Hong Li, Richard N Kitsis, Rajesh Patel, Edward Owusu-Ansa. IDH2-mediated regulation of the biogenesis of the oxidative phosphorylation system. Science advances. vol 8. issue 19. 2022-05-11. PMID:35544578. |
several subunits in the matrix domain of mitochondrial complex i (ci) have been posited to be redox sensors for ci, but how elevated levels of reactive oxygen species (ros) impinge on ci assembly is unknown. |
2022-05-11 |
2023-08-13 |
Not clear |
| C Boente, M T D Albuquerque, J R Gallego, V Pawlowsky-Glahn, J J Egozcu. Compositional baseline assessments to address soil pollution: An application in Langreo, Spain. The Science of the total environment. 2021-12-24. PMID:34952083. |
the steps of this new methodology are: 1) exploratory data analysis through variation matrix, biplots or coda dendrograms; 2) selection of geological background in terms of a trimmed subsample that can be assumed as non-pollutant; 3) computing the spread aitchison distance from each sample point to the trimmed sample; 4) performing a compositional balance able to predict the aitchison distance computed in step 3.identifying a compositional balance, including pollutant and non-pollutant elements, with sparsity and simplicity as properties, is crucial for the construction of a compositional pollution indicator (ci). |
2021-12-24 |
2023-08-13 |
human |
| Keshavamurthy Vinay, Vignesh Narayan, Vishal Thakur, Rajat Choudhary, Tarun Narang, Sunil Dogra, Shoban Babu Varthy. Efficacy and safety of phenol based partial matricectomy in treatment of onychocryptosis: A systematic review and meta-analysis. Journal of the European Academy of Dermatology and Venereology : JEADV. 2021-12-16. PMID:34913204. |
we found that nail matrix phenolisation was associated with a 49 fewer number of recurrences per thousand patients compared to other modalities (or: 0.28 - 0.57, ci 95%). |
2021-12-16 |
2023-08-13 |
human |
| Hamid Reza Marateb, Farzad Ziaie Nezhad, Mohammad Reza Mohebian, Ramin Sami, Shaghayegh Haghjooy Javanmard, Fatemeh Dehghan Niri, Mahsa Akafzadeh-Savari, Marjan Mansourian, Miquel Angel Mañanas, Martin Wolkewitz, Harald Binde. Automatic Classification Between COVID-19 and Non-COVID-19 Pneumonia Using Symptoms, Comorbidities, and Laboratory Findings: The Khorshid COVID Cohort Study. Frontiers in medicine. vol 8. 2021-12-07. PMID:34869483. |
performance indices of the cross-validated confusion matrix for dataset 1 were as follows: sensitivity of 96% [confidence interval, ci, 95%: 94-98], specificity of 95% [90-99], positive predictive value (ppv) of 99% [98-100], negative predictive value (npv) of 82% [76-89], diagnostic odds ratio (dor) of 496 [198-1,245], area under the roc (auc) of 0.96 [0.94-0.97], matthews correlation coefficient (mcc) of 0.87 [0.85-0.88], accuracy of 96% [94-98], and cohen's kappa of 0.86 [0.81-0.91]. |
2021-12-07 |
2023-08-13 |
Not clear |
| Francesca Rigiroli, Jocelyn Hoye, Reginald Lerebours, Kyle J Lafata, Cai Li, Mathias Meyer, Peijie Lyu, Yuqin Ding, Fides R Schwartz, Niharika B Mettu, Sabino Zani, Sheng Luo, Desiree E Morgan, Ehsan Samei, Daniele Mari. CT Radiomic Features of Superior Mesenteric Artery Involvement in Pancreatic Ductal Adenocarcinoma: A Pilot Study. Radiology. vol 301. issue 3. 2021-11-29. PMID:34491129. |
the model with five features (maximum hugging angle, maximum diameter, logarithm robust mean absolute deviation, minimum distance, square gray level co-occurrence matrix correlation) showed a better performance compared with the radiologist assessment (model vs radiologist area under the curve, 0.71 [95% ci: 0.62, 0.79] vs 0.54 [95% ci: 0.50, 0.59]; |
2021-11-29 |
2023-08-13 |
Not clear |
| Yangyang Song, Yang Guo, Yibo Lei, Ning Zhang, Wenjian Li. The Static-Dynamic-Static Family of Methods for Strongly Correlated Electrons: Methodology and Benchmarking. Topics in current chemistry (Cham). vol 379. issue 6. 2021-11-12. PMID:34724123. |
born from the (restricted) static-dynamic-static (sds) framework for designing many-electron wave functions, sdsci is a minimal multireference (mr) configuration interaction (ci) approach that constructs and diagonalizes a [formula: see text] matrix for [formula: see text] states, regardless of the numbers of orbitals and electrons to be correlated. |
2021-11-12 |
2023-08-13 |
Not clear |
| Yangyang Song, Yang Guo, Yibo Lei, Ning Zhang, Wenjian Li. The Static-Dynamic-Static Family of Methods for Strongly Correlated Electrons: Methodology and Benchmarking. Topics in current chemistry (Cham). vol 379. issue 6. 2021-11-12. PMID:34724123. |
if the full molecular hamiltonian h in the qhq block (which describes couplings between functions of the first-order interaction space q) of the sdsci ci matrix is replaced with a zeroth-order hamiltonian [formula: see text] before the diagonalization is taken, we obtain sdspt2, a ci-like second-order perturbation theory (pt2). |
2021-11-12 |
2023-08-13 |
Not clear |
| Jennifer Worhach, Madeline Boduch, Bo Zhang, Kiran Mask. Remote Assessment of Cognition in Kids and Adolescents with Daytime Sleepiness: A pilot study of feasibility and reliability. medRxiv : the preprint server for health sciences. 2021-10-26. PMID:33791741. |
matrix reasoning t-scores showed moderate reliability (icc 0.69, 95% ci: 0.68, 0.90) and block design t-scores was poor between testing conditions. |
2021-10-26 |
2023-08-13 |
human |
| Xiaojie Liu, Yanpei Tian, Yanzi Wu, Fangqi Chen, Ying Mu, Marilyn L Minus, Yi Zhen. Fully Biomass-Based Hybrid Hydrogel for Efficient Solar Desalination with Salt Self-Cleaning Property. ACS applied materials & interfaces. vol 13. issue 36. 2021-09-16. PMID:34469114. |
here, we demonstrate a sustainable, nontoxic, and highly efficient fully biomass-based gg/ci hydrogel evaporator consisting of gellan gum (gg) hydrogel as the matrix and cuttlefish ink (ci) as the photothermal material. |
2021-09-16 |
2023-08-13 |
Not clear |
| Han Youl Lee, Maia Jack, Theresa Poon, Daniel Noori, Carolina Venditti, Samer Hamamji, Kathy Musa-Velos. Effects of Unsweetened Preloads and Preloads Sweetened with Caloric or Low-/No-Calorie Sweeteners on Subsequent Energy Intakes: A Systematic Review and Meta-Analysis of Controlled Human Intervention Studies. Advances in nutrition (Bethesda, Md.). vol 12. issue 4. 2021-08-18. PMID:33439973. |
energy intakes at an ad libitum meal were significantly lower for low-/no-calorie sweetener (lncs)-sweetened compared with unsweetened preloads in the isocaloric comparison (-55.5 kcal; 95% ci: -82.9, -28.0 kcal; p < 0.001); however, the difference in energy intake was not significant in additional sensitivity analyses (i.e., removal of comparisons where the matrix was a capsule and when xylitol was the lncs). |
2021-08-18 |
2023-08-13 |
human |
| Abhishek Khedkar, Michael Roemel. Modern multireference methods and their application in transition metal chemistry. Physical chemistry chemical physics : PCCP. vol 23. issue 32. 2021-08-18. PMID:34355719. |
in the last years multiple methods such as modern variants of selected ci, full-ci quantum monte carlo (fciqmc) and the density matrix renormalization group (dmrg) have been developed that solve the full-ci problem approximately for a fraction of the computational cost required by conventional techniques thereby significantly extending the range of applicability of modern mr methods. |
2021-08-18 |
2023-08-13 |
Not clear |
| Qiang Zhang, Birgit Rudolph, Mira Choi, Friederike Bachmann, Danilo Schmidt, Michael Duerr, Marcel G Naik, Wiebke Duettmann, Eva Schrezenmeier, Manuel Mayrdorfer, Fabian Halleck, Kaiyin Wu, Klemens Budd. The relationship between proteinuria and allograft survival in patients with transplant glomerulopathy: a retrospective single-center cohort study. Transplant international : official journal of the European Society for Organ Transplantation. vol 34. issue 2. 2021-06-28. PMID:33205460. |
proteinuria was associated with graft loss in univariable cox regression [hazard ratio (hr) 1.25, 95% ci, 1.11-1.41, p < 0.001], and in multivariable analysis (adjusted hr 1.26, 95% ci 1.11-1.42, p < 0.001) independent of other risk factors including creatinine at biopsy, positive c4d, history of rejection, and banff lesion score mesangial matrix expansion. |
2021-06-28 |
2023-08-13 |
Not clear |