spartan software version 18 (Wavefunction inc)
90
Structured Review
Wavefunction inc
spartan software version 18
Spartan Software Version 18, supplied by Wavefunction inc, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/spartan%E2%80%9918+software/spartan+software+version+18/pm40649394-166-13-17
Average 90 stars, based on 1 article reviews
Spartan Software Version 18, supplied by Wavefunction inc, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/spartan%E2%80%9918+software/spartan+software+version+18/pm40649394-166-13-17
Average 90 stars, based on 1 article reviews
spartan software version 18 - by Bioz Stars,
2026-09
90/100 stars
Images
Related Articles
Functional Assay:Article Title: Anticancer Activity of Phospholipid-Dexibuprofen Conjugates Loaded in Nanostructured Lipid Carriers Article Snippet: The SPARTAN’18 software was used for the Article Title: Multifunctional Indomethacin Conjugates for the Development of Nanosystems Targeting Cancer Treatment Article Snippet: Quantum calculations of the HOMO and LUMO energies (E HOMO and E LUMO, respectively), area, volume, ovality, and polarizability were performed using the Article Title: Synthesis of Cobalt(III) Complexes Derived from Pyridoxal: Structural Cleavage Evaluations and In Silico Calculations for Biological Targets Article Snippet: The chemical structure of C1’–C4’ and C1–C4 were obtained from the experimental X-ray data, while the superoxide ions (O2−) were built and energy minimized with the Density Functional Theory (DFT) method with Article Title: Design and Synthesis of Bis-Chalcones as Curcumin Simplified Analogs and Assessment of Their Antiproliferative Activities Against Human Lung Cancer Cells and Trypanosoma cruzi Amastigotes Article Snippet: The structures of the cancer-related targets and the three isoforms of cytochrome P450 (CYP450) were obtained in the Protein Data Bank (PDB) with the access codes 1M17 [ ], 2W3L [ ], 3DCY, 3G0E [ ], 6QHD [ ], 2HI4 [ ], 1R9O [ ], and 1W0F [ ], while the three-dimensional structures for compounds 1 – 12 were built and energy-minimized with Article Title: Novel Schiff's base liquid crystalline trifluoromethoxy aniline derivatives of cinnamoyl ester Article Snippet: A novel homologous series of cinnamoyl ester encompassing of twelve homologues liquid crystal samples containing 4′-trifluoromethoxy aniline moiety have been designed and developed to understand their mesophase analysis using polarizing optical microscope, differential scanning calorimetry, spectral analysis and density functional theory approach.. The prepared each samples show nematic-smectic A phase with good temperature range of mesophase affected by the variation of side alkyl chains.. In addition, present LC samples of cinnamoyl ester trifluro derivatives were tested for their antimicrobial performance and the obtained results reveals a good biological potential for the studied LC homologous series. Article Title: The Catalysis Mechanism of E. coli Nitroreductase A, a Candidate for Gene-Directed Prodrug Therapy: Potentiometric and Substrate Specificity Studies. Article Snippet: All computational analyses were performed using Article Title: Using multi-spectroscopic techniques to evaluate photophysical, photobiological and bio-interactive properties of meso‑5,15-bis(substituted)porphyrins Article Snippet: The use of trans-substituted porphyrins with the most diverse substituents in the meso‐aryl positions of the macrocycle is reported.. The photophysical behavior of these porphyrins were studied using multi-spectroscopic techniques, both in the ground and excited states, as well as theoretical calculations, e.g., natural transitions orbitals (NTOs) analysis).. Photobiological data such as photostability, hydrophilicity (log POW), and ROSproducing (singlet oxygen and superoxide species) were also evaluated by classical analysis and electron paramagnetic resonance spectroscopy (EPR) spin trap assays. Article Title: Multifunctional Indomethacin Conjugates for the Development of Nanosystems Targeting Cancer Treatment Article Snippet: Quantum calculations of the HOMO and LUMO energies (EHOMO and ELUMO, respectively), area, volume, ovality, and polarizability were performed using the Software:Article Title: Anticancer Activity of Phospholipid-Dexibuprofen Conjugates Loaded in Nanostructured Lipid Carriers Article Snippet: The SPARTAN’18 software was used for the Article Title: Multifunctional Indomethacin Conjugates for the Development of Nanosystems Targeting Cancer Treatment Article Snippet: Quantum calculations of the HOMO and LUMO energies (E HOMO and E LUMO, respectively), area, volume, ovality, and polarizability were performed using the Article Title: Synthesis of Cobalt(III) Complexes Derived from Pyridoxal: Structural Cleavage Evaluations and In Silico Calculations for Biological Targets Article Snippet: The chemical structure of C1’–C4’ and C1–C4 were obtained from the experimental X-ray data, while the superoxide ions (O2−) were built and energy minimized with the Density Functional Theory (DFT) method with Article Title: Design and Synthesis of Bis-Chalcones as Curcumin Simplified Analogs and Assessment of Their Antiproliferative Activities Against Human Lung Cancer Cells and Trypanosoma cruzi Amastigotes Article Snippet: The structures of the cancer-related targets and the three isoforms of cytochrome P450 (CYP450) were obtained in the Protein Data Bank (PDB) with the access codes 1M17 [ ], 2W3L [ ], 3DCY, 3G0E [ ], 6QHD [ ], 2HI4 [ ], 1R9O [ ], and 1W0F [ ], while the three-dimensional structures for compounds 1 – 12 were built and energy-minimized with Article Title: Novel Schiff's base liquid crystalline trifluoromethoxy aniline derivatives of cinnamoyl ester Article Snippet: A novel homologous series of cinnamoyl ester encompassing of twelve homologues liquid crystal samples containing 4′-trifluoromethoxy aniline moiety have been designed and developed to understand their mesophase analysis using polarizing optical microscope, differential scanning calorimetry, spectral analysis and density functional theory approach.. The prepared each samples show nematic-smectic A phase with good temperature range of mesophase affected by the variation of side alkyl chains.. In addition, present LC samples of cinnamoyl ester trifluro derivatives were tested for their antimicrobial performance and the obtained results reveals a good biological potential for the studied LC homologous series. Article Title: The Catalysis Mechanism of E. coli Nitroreductase A, a Candidate for Gene-Directed Prodrug Therapy: Potentiometric and Substrate Specificity Studies. Article Snippet: All computational analyses were performed using Article Title: Using multi-spectroscopic techniques to evaluate photophysical, photobiological and bio-interactive properties of meso‑5,15-bis(substituted)porphyrins Article Snippet: The use of trans-substituted porphyrins with the most diverse substituents in the meso‐aryl positions of the macrocycle is reported.. The photophysical behavior of these porphyrins were studied using multi-spectroscopic techniques, both in the ground and excited states, as well as theoretical calculations, e.g., natural transitions orbitals (NTOs) analysis).. Photobiological data such as photostability, hydrophilicity (log POW), and ROSproducing (singlet oxygen and superoxide species) were also evaluated by classical analysis and electron paramagnetic resonance spectroscopy (EPR) spin trap assays. Article Title: Multifunctional Indomethacin Conjugates for the Development of Nanosystems Targeting Cancer Treatment Article Snippet: Quantum calculations of the HOMO and LUMO energies (EHOMO and ELUMO, respectively), area, volume, ovality, and polarizability were performed using the Molecular Weight:Article Title: Anticancer Activity of Phospholipid-Dexibuprofen Conjugates Loaded in Nanostructured Lipid Carriers Article Snippet: The SPARTAN’18 software was used for the Article Title: Multifunctional Indomethacin Conjugates for the Development of Nanosystems Targeting Cancer Treatment Article Snippet: Quantum calculations of the HOMO and LUMO energies (E HOMO and E LUMO, respectively), area, volume, ovality, and polarizability were performed using the Article Title: Synthesis of Cobalt(III) Complexes Derived from Pyridoxal: Structural Cleavage Evaluations and In Silico Calculations for Biological Targets Article Snippet: The chemical structure of C1’–C4’ and C1–C4 were obtained from the experimental X-ray data, while the superoxide ions (O2−) were built and energy minimized with the Density Functional Theory (DFT) method with Article Title: Design and Synthesis of Bis-Chalcones as Curcumin Simplified Analogs and Assessment of Their Antiproliferative Activities Against Human Lung Cancer Cells and Trypanosoma cruzi Amastigotes Article Snippet: The structures of the cancer-related targets and the three isoforms of cytochrome P450 (CYP450) were obtained in the Protein Data Bank (PDB) with the access codes 1M17 [ ], 2W3L [ ], 3DCY, 3G0E [ ], 6QHD [ ], 2HI4 [ ], 1R9O [ ], and 1W0F [ ], while the three-dimensional structures for compounds 1 – 12 were built and energy-minimized with Article Title: Novel Schiff's base liquid crystalline trifluoromethoxy aniline derivatives of cinnamoyl ester Article Snippet: A novel homologous series of cinnamoyl ester encompassing of twelve homologues liquid crystal samples containing 4′-trifluoromethoxy aniline moiety have been designed and developed to understand their mesophase analysis using polarizing optical microscope, differential scanning calorimetry, spectral analysis and density functional theory approach.. The prepared each samples show nematic-smectic A phase with good temperature range of mesophase affected by the variation of side alkyl chains.. In addition, present LC samples of cinnamoyl ester trifluro derivatives were tested for their antimicrobial performance and the obtained results reveals a good biological potential for the studied LC homologous series. Article Title: The Catalysis Mechanism of E. coli Nitroreductase A, a Candidate for Gene-Directed Prodrug Therapy: Potentiometric and Substrate Specificity Studies. Article Snippet: All computational analyses were performed using Article Title: Using multi-spectroscopic techniques to evaluate photophysical, photobiological and bio-interactive properties of meso‑5,15-bis(substituted)porphyrins Article Snippet: The use of trans-substituted porphyrins with the most diverse substituents in the meso‐aryl positions of the macrocycle is reported.. The photophysical behavior of these porphyrins were studied using multi-spectroscopic techniques, both in the ground and excited states, as well as theoretical calculations, e.g., natural transitions orbitals (NTOs) analysis).. Photobiological data such as photostability, hydrophilicity (log POW), and ROSproducing (singlet oxygen and superoxide species) were also evaluated by classical analysis and electron paramagnetic resonance spectroscopy (EPR) spin trap assays. Article Title: Multifunctional Indomethacin Conjugates for the Development of Nanosystems Targeting Cancer Treatment Article Snippet: Quantum calculations of the HOMO and LUMO energies (EHOMO and ELUMO, respectively), area, volume, ovality, and polarizability were performed using the |