Works matching Molecular Formula
Results: 1498
基于分子式数据库策略的 FM-searcher 软件 在危害物非目标筛查分子式预测中的应用.
- Published in:
- Journal of Chinese Mass Spectrometry Society, 2020, v. 41, n. 5, p. 453, doi. 10.7538/zpxb.2019.0038
- By:
- Publication type:
- Article
AN UNIFIED FORMULA FOR DERIVING THE MOLECULAR COMPOSITION OF HYDROCARBONS.
- Published in:
- Technical Transactions / Czasopismo Techniczne, 2017, v. 3, p. 41, doi. 10.4467/2353737XCT.17.030.6341
- By:
- Publication type:
- Article
Automation of chemical assignment for identifying molecular formula of S-containing metabolites by combining metabolomics and chemoinformatics with S labeling.
- Published in:
- Metabolomics, 2016, v. 12, n. 11, p. 1, doi. 10.1007/s11306-016-1115-5
- By:
- Publication type:
- Article
Simultaneous molecular formula determinations of natural compounds in a plant extract using 15 T Fourier transform ion cyclotron resonance mass spectrometry.
- Published in:
- Plant Methods, 2013, v. 9, n. 1, p. 1, doi. 10.1186/1746-4811-9-15
- By:
- Publication type:
- Article
Simultaneous molecular formula determinations of natural compounds in a plant extract using 15 T Fourier transform ion cyclotron resonance mass spectrometry.
- Published in:
- Plant Methods, 2013, v. 9, n. 1, p. 1, doi. 10.1186/1746-4811-9-15
- By:
- Publication type:
- Article
PYTHON PROGRAM FOR STRUCTURE AND MOLECULAR FORMULA OF ORGANIC COMPOUNDS: AN ALTERNATIVE THEORETICAL APPROACH.
- Published in:
- Rasayan Journal of Chemistry, 2024, v. 17, n. 4, p. 1460, doi. 10.31788/RJC.2024.1748848
- By:
- Publication type:
- Article
Influence of heteroatom pre-selection on the molecular formula assignment of soil organic matter components determined by ultrahigh resolution mass spectrometry.
- Published in:
- Analytical & Bioanalytical Chemistry, 2013, v. 405, n. 10, p. 3299, doi. 10.1007/s00216-013-6734-3
- By:
- Publication type:
- Article
Determining the Molecular Formula of [Fe(acac)<sub>3</sub>] (acacH = acetylacetone): A Simple Analytical Chemistry Experiment for High School Students.
- Published in:
- Resonance: Journal of Science Education, 2022, v. 27, n. 9, p. 1625, doi. 10.1007/s12045-022-1453-8
- By:
- Publication type:
- Article
Determination of Molecular Formula of Potassium Tris(oxalato)ferrate(III) Trihydrate.
- Published in:
- 2022
- By:
- Publication type:
- Announcement
A simplified strategy for molecular formula determination of chemical constituents in traditional Chinese medicines based on accurate mass, A + 1 and A + 2 isotopic peaks using Fourier transform ion cyclotron resonance mass spectrometry.
- Published in:
- Rapid Communications in Mass Spectrometry: RCM, 2020, v. 34, n. 24, p. 1, doi. 10.1002/rcm.8933
- By:
- Publication type:
- Article
Seven Golden Rules for heuristic filtering of molecular formulas obtained by accurate mass spectrometry.
- Published in:
- BMC Bioinformatics, 2007, v. 8, p. 105, doi. 10.1186/1471-2105-8-105
- By:
- Publication type:
- Article
Atmospheric organic matter in clouds: exact masses and molecular formula identification using ultrahigh-resolution FT-ICR mass spectrometry.
- Published in:
- Atmospheric Chemistry & Physics, 2013, v. 13, n. 24, p. 12343, doi. 10.5194/acp-13-12343-2013
- By:
- Publication type:
- Article
Prediction of Molecular Mechanisms for LianXia NingXin Formula: A Network Pharmacology Study.
- Published in:
- Frontiers in Physiology, 2018, p. 1, doi. 10.3389/fphys.2018.00489
- By:
- Publication type:
- Article
A proposed approach to defining per‐ and polyfluoroalkyl substances (PFAS) based on molecular structure and formula.
- Published in:
- Integrated Environmental Assessment & Management, 2023, v. 19, n. 5, p. 1333, doi. 10.1002/ieam.4735
- By:
- Publication type:
- Article
Molecular formula assignment for dissolved organic matter (DOM) using high-field FT-ICR-MS: chemical perspective and validation of sulphur-rich organic components (CHOS) in pit lake samples.
- Published in:
- Analytical & Bioanalytical Chemistry, 2016, v. 408, n. 10, p. 2461, doi. 10.1007/s00216-016-9341-2
- By:
- Publication type:
- Article
The isotopic mass defect: a tool for limiting molecular formulas by accurate mass.
- Published in:
- Analytical & Bioanalytical Chemistry, 2010, v. 397, n. 7, p. 2807, doi. 10.1007/s00216-010-3562-6
- By:
- Publication type:
- Article
Mass spectrometric determination of molecular formulas for membrane-modifying antibiotics.
- Published in:
- Nature, 1977, v. 269, n. 5631, p. 832, doi. 10.1038/269832a0
- By:
- Publication type:
- Article
Automatic Assignment of Molecular Ion Species to Elemental Formulas in Gas Chromatography/Methane Chemical Ionization Accurate Mass Spectrometry.
- Published in:
- Metabolites (2218-1989), 2023, v. 13, n. 8, p. 962, doi. 10.3390/metabo13080962
- By:
- Publication type:
- Article
Deriving Lipid Classification Based on Molecular Formulas.
- Published in:
- Metabolites (2218-1989), 2020, v. 10, n. 3, p. 122, doi. 10.3390/metabo10030122
- By:
- Publication type:
- Article
Design strategies for organic semiconductors beyond the molecular formula.
- Published in:
- Nature Chemistry, 2012, v. 4, n. 9, p. 699, doi. 10.1038/nchem.1422
- By:
- Publication type:
- Article
Learning with NanoKid: line-angle formula, chemical formula, molecular weight, and elemental analysis.
- Published in:
- Chemistry Teacher International, 2024, v. 6, n. 3, p. 331, doi. 10.1515/cti-2024-0029
- By:
- Publication type:
- Article
A Computational Systems Pharmacology Approach to Investigate Molecular Mechanisms of Herbal Formula Tian-Ma-Gou-Teng-Yin for Treatment of Alzheimer’s Disease.
- Published in:
- Frontiers in Pharmacology, 2018, p. N.PAG, doi. 10.3389/fphar.2018.00668
- By:
- Publication type:
- Article
Network Pharmacology, Molecular Docking and Experimental Exploring Molecular Mechanisms of Yinqiao Anti-Epidemic Formula in Regulating Mucosal Immune System of Respiratory Tract.
- Published in:
- Agricultural Biotechnology (2164-4993), 2023, v. 12, n. 4, p. 75, doi. 10.19759/j.cnki.2164-4993.2023.04.017
- By:
- Publication type:
- Article
Inferring the Contribution of Microbial Taxa and Organic Matter Molecular Formulas to Ecological Assembly.
- Published in:
- Frontiers in Microbiology, 2022, v. 13, p. 1, doi. 10.3389/fmicb.2022.803420
- By:
- Publication type:
- Article
Some approximate Kohn-Sham molecular energy formulas.
- Published in:
- Molecular Physics, 1998, v. 95, n. 4, p. 681, doi. 10.1080/002689798166675
- By:
- Publication type:
- Article
Molecular formula analysis of fragment ions by isotope-selective collision-induced dissociation tandem mass spectrometry of pharmacologically active compounds.
- Published in:
- Journal of Mass Spectrometry, 2014, v. 49, n. 12, p. 1322, doi. 10.1002/jms.3468
- By:
- Publication type:
- Article
Formula optimization of low molecular weight heparin gel and its effect on the mouse model of pruritus.
- Published in:
- Pharmaceutial Care & Research, 2015, v. 15, n. 2, p. 107, doi. 10.5428/pcar20150207
- By:
- Publication type:
- Article
A Mechanization of Algebraic Differentiation and the Automatic Generation of Formulae for Molecular Integrals of Gaussian Orbitals.
- Published in:
- Computer Journal, 1963, v. 6, n. 3, p. 287
- By:
- Publication type:
- Article
The Molecular Formulæ of Aluminium Compounds.
- Published in:
- Nature, 1889, v. 39, n. 1014, p. 536, doi. 10.1038/039536a0
- By:
- Publication type:
- Article
重量法结合氨基酸分析法测定婴幼儿配方乳粉中 小分子蛋白肽含量.
- Published in:
- Food & Machinery, 2023, n. 3, p. 44, doi. 10.13652/j.spjx.l003.578&2022.80143
- By:
- Publication type:
- Article
Supplementing formula-fed piglets with a low molecular weight fraction of bovine colostrum whey results in an improved intestinal barrier.
- Published in:
- Journal of Animal Science, 2014, v. 92, n. 8, p. 3491, doi. 10.2527/jas.2013-6437
- By:
- Publication type:
- Article
The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching.
- Published in:
- Journal of Cheminformatics, 2017, v. 9, n. 1, p. 1, doi. 10.1186/s13321-017-0220-4
- By:
- Publication type:
- Article
Investigation of compound-independent calibration and partial molecular formula determination by gas chromatography–atomic-emission detection for characterisation of organophosphorus and organosulfur agents related to the chemical weapons convention
- Published in:
- Analytical & Bioanalytical Chemistry, 2005, v. 383, n. 5, p. 848, doi. 10.1007/s00216-005-0064-z
- By:
- Publication type:
- Article
Understanding molecular formula assignment of Fourier transform ion cyclotron resonance mass spectrometry data of natural organic matter from a chemical point of view.
- Published in:
- Analytical & Bioanalytical Chemistry, 2014, v. 406, n. 30, p. 7977, doi. 10.1007/s00216-014-8249-y
- By:
- Publication type:
- Article
Generation of standard gas mixtures of halogenated, aliphatic, and aromatic compounds and prediction of the individual output rates based on molecular formula and boiling point.
- Published in:
- Analytical & Bioanalytical Chemistry, 2012, v. 404, n. 8, p. 2177, doi. 10.1007/s00216-012-6202-5
- By:
- Publication type:
- Article
基于整合药理学平台 V2.0 探讨痰瘀同治方抗心肌 缺血再灌注损伤的分子机制.
- Published in:
- Evaluation & Analysis of Drug-Use in Hospitals of China / Zhongguo Yiyuan Yongyao Pingjia yu Fenxi, 2021, n. 3, p. 273, doi. 10.14009/j.issn.1672-2124.2021.03.004
- By:
- Publication type:
- Article
Biothermodynamics of Hemoglobin and Red Blood Cells: Analysis of Structure and Evolution of Hemoglobin and Red Blood Cells, Based on Molecular and Empirical Formulas, Biosynthesis Reactions, and Thermodynamic Properties of Formation and Biosynthesis.
- Published in:
- Journal of Molecular Evolution, 2024, v. 92, n. 6, p. 776, doi. 10.1007/s00239-024-10205-9
- By:
- Publication type:
- Article
Syntactic definition and parsing of molecular formulae, part 2: graphical synthesis of molecular formulae for data base queries.
- Published in:
- Computer Journal, 1978, v. 21, n. 3, p. 224
- By:
- Publication type:
- Article
Uncovering the Mechanisms and Molecular Targets of Weibing Formula 1 against Gastritis: Coupling Network Pharmacology with GEO Database.
- Published in:
- BioMed Research International, 2021, p. 1, doi. 10.1155/2021/5533946
- By:
- Publication type:
- Article
Analysis of Molecular Mechanism of YiqiChutan Formula Regulating DLL4-Notch Signaling to Inhibit Angiogenesis in Lung Cancer.
- Published in:
- BioMed Research International, 2021, p. 1, doi. 10.1155/2021/8875503
- By:
- Publication type:
- Article
Elucidation of the Mechanisms and Molecular Targets of Yiqi Shexue Formula for Treatment of Primary Immune Thrombocytopenia Based on Network Pharmacology.
- Published in:
- Frontiers in Pharmacology, 2019, p. 1, doi. 10.3389/fphar.2019.01136
- By:
- Publication type:
- Article
含白芷方剂组方规律及核心药对 "白芷(川芎"分子机制的研究.
- Published in:
- China Journal of Chinese Materia Medica, 2018, v. 43, n. 7, p. 1331
- By:
- Publication type:
- Article
金银花配方颗粒的位点特异性 PCR 鉴别研究.
- Published in:
- China Journal of Chinese Materia Medica, 2017, v. 42, n. 13, p. 2484
- By:
- Publication type:
- Article
Study of effective components and molecular mechanism for Guizhi Fuling formula treatment of dysmenorrhea, pelvic inflammatory disease and uterine fibroids.
- Published in:
- China Journal of Chinese Materia Medica, 2015, v. 40, n. 6, p. 999, doi. 10.4268/cjcmm20150603
- By:
- Publication type:
- Article
Recurrence formulas for molecular integrals over Laguerre Gaussian-type functions.
- Published in:
- International Journal of Quantum Chemistry, 1997, v. 66, n. 4, p. 273, doi. 10.1002/(SICI)1097-461X(1998)66:4<273::AID-QUA2>3.0.CO;2-S
- By:
- Publication type:
- Article
Computer-generated formulas for some three-center molecular integrals over Slater-type orbitals.
- Published in:
- International Journal of Quantum Chemistry, 1983, v. 23, n. 3, p. 953, doi. 10.1002/qua.560230318
- By:
- Publication type:
- Article
Generalized Christoffel–Darboux formulae and the frontier Kohn–Sham molecular orbitals.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2003, v. 110, n. 4, p. 267, doi. 10.1007/s00214-003-0446-2
- By:
- Publication type:
- Article
Integrated serum metabolomics and network pharmacology reveal molecular mechanism of Qixue Huazheng formula on peritoneal fibrosis.
- Published in:
- Frontiers in Pharmacology, 2025, p. 1, doi. 10.3389/fphar.2025.1515038
- By:
- Publication type:
- Article
Syntactic definition and parsing of molecular formulae: Part 1 Initial syntax definition and parser implementation.
- Published in:
- Computer Journal, 1975, v. 18, n. 4, p. 355
- By:
- Publication type:
- Article
Identifying the Mechanisms and Molecular Targets of Yizhiqingxin Formula on Alzheimer's Disease: Coupling Network Pharmacology with GEO Database.
- Published in:
- Pharmacogenomics & Personalized Medicine, 2020, p. 487, doi. 10.2147/PGPM.S269726
- By:
- Publication type:
- Article