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Machine learning prediction for COVID-19 disease severity at hospital admission

BMC medical informatics and decision making, 2023-03, Vol.23 (1), p.46-46, Article 46

2023

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Structural screening and molecular simulation identify potential ligands against the K700E hot spot variant and functional pockets of SF3B1 to modulate splicing in myelodysplastic syndrome

Heliyon, 2024-06, Vol.10 (12), p.e32729, Article e32729

2024

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Boron-doped hydrogenated Al3 clusters: A material for hydrogen storage

Journal of alloys and compounds, 2016-05, Vol.667, p.275-281

2016

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Structural transformations in the carborane series: CnB6−nH6 (n=0–6) upon substitution of boron by carbon

Inorganica Chimica Acta, 2016-11, Vol.453, p.626-632

2016

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Half-metallicity in the inverse Heusler Ti2RuSn alloy: A first-principles prediction

Journal of magnetism and magnetic materials, 2017-03, Vol.426, p.473-478

2017

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Some characteristic behavior of spin-1 Ising nanotube

Physics letters. A, 2011-09, Vol.375 (41), p.3547-3551

2011

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Structural transformations in the carborane series: C^sub n^B^sub 6-n^H^sub 6^ (n = 0–6) upon substitution of boron by carbon

Inorganica Chimica Acta, 2016-11, Vol.453, p.626

2016

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Half-Metallic Ferrimagnetism in the Mn2NbAl Full-Heusler Compound: a First-Principles Study

Journal of superconductivity and novel magnetism, 2016, Vol.29 (1), p.187-192

2016

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Pyrophosphate Release in the Protein HIV Reverse Transcriptase

The journal of physical chemistry. B, 2017-10, Vol.121 (41), p.9557-9565

2017

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Structural, antimicrobial and computational characterization of 1-benzoyl-3-(5-chloro-2-hydroxyphenyl)thiourea

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2012-12, Vol.98, p.290-301

2012

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Search for the global minimum structures of AlB3H2n (n = 0 − 6) clusters

Journal of computational chemistry, 2015-03, Vol.36 (6), p.385-391

2015

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Prediction of Outcome in Hospitalized Patients with COVID-19: Development of a COVID-19 Scoring Prognostic Model

Blood, 2022-11, Vol.140 (Supplement 1), p.11224-11225

2022

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Magnetism and Half-Metallicity in the Fe2ZrP Heusler Alloy

Journal of superconductivity and novel magnetism, 2016-10, Vol.29 (10), p.2573-2578

2016

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Stochastic search, fragmentation, electronic and reactivity properties of neutral and cationic hydrogenated Li6 clusters

Journal of molecular structure, 2014-05, Vol.1065-1066, p.65-73

2014

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Structural, spectral, optical and antimicrobial properties of synthesized 1-benzoyl-3-furan-2-ylmethyl-thiourea

Journal of molecular structure, 2013-09, Vol.1048, p.69-77

2013

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Ab initio search for global minimum structures of neutral and anionic hydrogenated Li5 clusters

Chemical physics, 2013-06, Vol.418, p.14-21

2013

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New organocobaloxime derivatives – Synthesis, characterization, catalase-like activity and DFT studies

Journal of organometallic chemistry, 2014-04, Vol.756, p.10-18

2014

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Structure, Ionization, and Fragmentation of Hydrogenated Aluminoboron Clusters: Al2B2H2n (n=0‐6)

ChemistrySelect (Weinheim), 2016-08, Vol.1 (13), p.3804-3811

2016

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Structural and computational characterization of 4′,4′,6′,6′-tetrachloro-3-(2-methoxyethyl)-3H,4H-spiro-1,3,2-benzoxaza phosphinine-2,2′- [1,3,5,2,4,6] triazatriphosphinine

Journal of molecular structure, 2016-08, Vol.1117, p.276-282

2016

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Search for the global minimum structures of AlB^sub 3^H^sub 2n^ (n = 0 - 6) clusters

Journal of computational chemistry, 2015-03, Vol.36 (6), p.385

2015

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Structure and energetic of B n ( n = 2–12) clusters: Electronic structure calculations

International journal of quantum chemistry, 2007-03, Vol.107 (3), p.729-744

2007

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Stochastic search, fragmentation, electronic and reactivity properties of neutral and cationic hydrogenated Li sub(6) clusters

Journal of molecular structure, 2014-05, Vol.1065-1066, p.65-73

2014

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Identification of potential antiviral compounds against SARS-CoV-2 structural and non structural protein targets: A pharmacoinformatics study of the CAS COVID-19 dataset

Computers in biology and medicine, 2021-06, Vol.133, p.104364-104364, Article 104364

2021

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Structural transformations in the carborane series: C B6−H6 (n= 0–6) upon substitution of boron by carbon

Inorganica Chimica Acta, 2016-11, Vol.453, p.626-632

2016

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Density Functional Study of Physical and Chemical Properties of Nano Size Boron Clusters: Bn (n = 13–20)

Chinese journal of chemical physics, 2009-08, Vol.22, p.380

2009

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Machine learning prediction for COVID-19 disease severity at hospital admission

Structural screening and molecular simulation identify potential ligands against the K700E hot spot variant and functional pockets of SF3B1 to modulate splicing in myelodysplastic syndrome

Boron-doped hydrogenated Al3 clusters: A material for hydrogen storage

Structural transformations in the carborane series: CnB6−nH6 (n=0–6) upon substitution of boron by carbon

Half-metallicity in the inverse Heusler Ti2RuSn alloy: A first-principles prediction

Some characteristic behavior of spin-1 Ising nanotube

Structural transformations in the carborane series: C^sub n^B^sub 6-n^H^sub 6^ (n = 0–6) upon substitution of boron by carbon

Half-Metallic Ferrimagnetism in the Mn2NbAl Full-Heusler Compound: a First-Principles Study

Pyrophosphate Release in the Protein HIV Reverse Transcriptase

Structural, antimicrobial and computational characterization of 1-benzoyl-3-(5-chloro-2-hydroxyphenyl)thiourea

Search for the global minimum structures of AlB3H2n (n = 0 − 6) clusters

Prediction of Outcome in Hospitalized Patients with COVID-19: Development of a COVID-19 Scoring Prognostic Model

Magnetism and Half-Metallicity in the Fe2ZrP Heusler Alloy

Stochastic search, fragmentation, electronic and reactivity properties of neutral and cationic hydrogenated Li6 clusters

Structural, spectral, optical and antimicrobial properties of synthesized 1-benzoyl-3-furan-2-ylmethyl-thiourea

Ab initio search for global minimum structures of neutral and anionic hydrogenated Li5 clusters

New organocobaloxime derivatives – Synthesis, characterization, catalase-like activity and DFT studies

Structure, Ionization, and Fragmentation of Hydrogenated Aluminoboron Clusters: Al2B2H2n (n=0‐6)

Structural and computational characterization of 4′,4′,6′,6′-tetrachloro-3-(2-methoxyethyl)-3H,4H-spiro-1,3,2-benzoxaza phosphinine-2,2′- [1,3,5,2,4,6] triazatriphosphinine

Search for the global minimum structures of AlB^sub 3^H^sub 2n^ (n = 0 - 6) clusters

Structure and energetic of B n ( n = 2–12) clusters: Electronic structure calculations

Stochastic search, fragmentation, electronic and reactivity properties of neutral and cationic hydrogenated Li sub(6) clusters

Identification of potential antiviral compounds against SARS-CoV-2 structural and non structural protein targets: A pharmacoinformatics study of the CAS COVID-19 dataset

Structural transformations in the carborane series: C B6−H6 (n= 0–6) upon substitution of boron by carbon

Density Functional Study of Physical and Chemical Properties of Nano Size Boron Clusters: Bn (n = 13–20)

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