المؤلفون: Glen E. Kellogg

المصدر: Molecules, Vol 29, Iss 12, p 2838 (2024)

مصطلحات موضوعية: hydropathic interactions, solvent-accessible surface area, membrane proteins, lipid interactions, Organic chemistry, QD241-441

وصف الملف: electronic resource

العلاقة: https://www.mdpi.com/1420-3049/29/12/2838Test; https://doaj.org/toc/1420-3049Test

الوصول الحر: https://doaj.org/article/70d1246078044e139f458ab7d19a1aceTest

المؤلفون: Jin Peng, Xiaoju Song, Xin Li, Yongkang Jiang, Guokui Liu, Yaoyao Wei, Qiying Xia

المصدر: Molecules, Vol 28, Iss 8, p 3557 (2023)

مصطلحات موضوعية: Triton X, micelle, hydration number, solvent accessible surface area, Organic chemistry, QD241-441

العلاقة: https://www.mdpi.com/1420-3049/28/8/3557Test; https://doaj.org/toc/1420-3049Test; https://doaj.org/article/70af57b16f644f35b1ca2928e9889a9cTest

الإتاحة: https://doi.org/10.3390/molecules28083557Test
https://doaj.org/article/70af57b16f644f35b1ca2928e9889a9cTest

المؤلفون: Shahid Khan, Muhammad Farhan Khalid, Safee Ullah Chaudhary, Maham Hamid

المصدر: International Journal of Molecular Sciences; Volume 23; Issue 21; Pages: 12771

مصطلحات موضوعية: Inorganic Chemistry, Organic Chemistry, General Medicine, Physical and Theoretical Chemistry, Molecular Biology, Spectroscopy, Catalysis, solvent accessible surface area (SASA), mass spectroscopy, protein phosphorylation, protection factor (PF), MATLAB toolbox, structured water, protein fold energetics, Computer Science Applications

وصف الملف: application/pdf

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::808e208b8b43c7926c1fb53f6f38d75dTest
https://doi.org/10.3390/ijms232112771Test

المؤلفون: Normi D. Gajjar, Tejas M. Dhameliya, Gaurang B. Shah

المصدر: Journal of Molecular Structure

مصطلحات موضوعية: RdRp, MD simulation, Molecular dynamic simulation, RoG, Radius of gyration, Coronavirus disease 2019 (COVID-19), Severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2), medicine.medical_treatment, viruses, RdRP, RNA-dependent RNA polymerase, RNA-dependent RNA polymerase, SARS CoV-2, Computational biology, 010402 general chemistry, RMSF, Root mean square fluctuation, 01 natural sciences, EM, Electron microscopy, Article, RMSD, Root mean square deviation, WHO, World health organization, Analytical Chemistry, PLpro, Papain-like protease, Inorganic Chemistry, HB, Hydrogen bond, Molecular dynamics, ADMET, Absorption, distribution, metabolism, excretion, and toxicity, medicine, SP, Standard precision, Spectroscopy, SASA, Solvent accessible surface area, Natural products, Protease, nsp, Non-structural protein, ASL, Atom specification language, 010405 organic chemistry, Chemistry, Drug discovery, Organic Chemistry, COVID-19, Corona virus disease-2019, MD simulation, SARS CoV-2, Severe acute respiratory syndrome coronavirus 2, ACE, Angiotensin converting enzyme, 0104 chemical sciences, Mpro, Main protease, 3CLpro, 3-chymotrypsin-like protease, Molecular docking, Severe acute respiratory syndrome coronavirus, Pharmacophore, Dscore, Druggability score, Mpro

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::3cbcd86929c630bee0f02aea8eacba86Test
https://pubmed.ncbi.nlm.nih.gov/33903778Test

المؤلفون: Csaba Magyar, Anikó Mentes, István Simon, Erzsébet Fichó

المصدر: International Journal of Molecular Sciences
International Journal of Molecular Sciences, Vol 20, Iss 20, p 5136 (2019)
Volume 20
Issue 20

مصطلحات موضوعية: Protein Folding, Globular protein, Protein Conformation, Intrinsically disordered proteins, Catalysis, Article, Inorganic Chemistry, lcsh:Chemistry, chemistry.chemical_compound, Structure-Activity Relationship, dehydrons, solvent accessible surface area, Physical and Theoretical Chemistry, Molecular Biology, Peptide sequence, lcsh:QH301-705.5, ion-pairs, Spectroscopy, chemistry.chemical_classification, mutual synergistic folding, Organic Chemistry, Intermolecular force, stabilization centers, General Medicine, Computer Science Applications, Amino acid, Folding (chemistry), Intrinsically Disordered Proteins, Crystallography, Monomer, inter-subunit interactions, Amino acid composition, chemistry, lcsh:Biology (General), lcsh:QD1-999, Protein Multimerization, Protein Binding

وصف الملف: application/pdf

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a90bcbf89d87b4f4fdc51ec5ac97344eTest
http://europepmc.org/articles/PMC6829572Test

المؤلفون: Irini Doytchinova, Mariyana Atanasova, Ivan Dimitrov, Evdokiya Salamanova

المصدر: Molecules
Volume 26
Issue 9
Molecules, Vol 26, Iss 2815, p 2815 (2021)

مصطلحات موضوعية: Models, Molecular, folding, Protein Folding, Coumaric Acids, Static Electricity, Pharmaceutical Science, Peptide, Ligands, amyloid-β peptide, Article, Protein Structure, Secondary, Analytical Chemistry, Ferulic acid, chemistry.chemical_compound, QD241-441, Drug Discovery, curcumin, Physical and Theoretical Chemistry, Protein secondary structure, chemistry.chemical_classification, Amyloid beta-Peptides, Protein Stability, Chemistry, Hydrogen bond, Organic Chemistry, solvent-accessible surface area, secondary structure, hydrogen bonding, Folding (chemistry), molecular dynamics simulation, Monomer, Chemistry (miscellaneous), Intramolecular force, Solvents, Curcumin, Biophysics, Molecular Medicine, ferulic acid

وصف الملف: application/pdf

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e75ec87cd76b46a8a4d020eb40778b76Test
https://doi.org/10.3390/molecules26092815Test

المؤلفون: Ayon Chakraborty, Snehasis Chowdhuri, Rajesh Ghosh, Ashis Biswas

المصدر: Journal of Molecular Structure

مصطلحات موضوعية: Drug, Justicia adhatoda, Severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2), In silico, media_common.quotation_subject, medicine.medical_treatment, Abbreviations used: COVID-19, corona virus disease 2019, Pharmacology, SARS CoV-2 main protease, Article, RMSF, root mean square fluctuation, Analytical Chemistry, RMSD, root mean square deviation, Inorganic Chemistry, Alkaloids, medicine, Vasaka, Spectroscopy, Darunavir, media_common, Protease, biology, Chemistry, Alkaloid, Organic Chemistry, COVID-19, Lopinavir, Docking and molecular dynamics simulation, Rg, radius of gyration, SARS CoV-2, severe acute respiratory syndrome corona virus-2, biology.organism_classification, MD, molecular dynamics, Mpro, main protease, SASA, solvent accessible surface area, medicine.drug

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::499cb9e99987c177bd892a28679a1ebeTest
https://doi.org/10.1016/j.molstruc.2020.129489Test

المؤلفون: Anikó Mentes, Csaba Magyar, Erzsébet Fichó, Miklós Cserző, István Simon

المصدر: International Journal of Molecular Sciences, Vol 19, Iss 11, p 3340 (2018)
International Journal of Molecular Sciences
Volume 19
Issue 11

مصطلحات موضوعية: 0301 basic medicine, Models, Molecular, Protein Folding, Protein Conformation, dehydron, homodimer, Intrinsically disordered proteins, Catalysis, Article, Inorganic Chemistry, lcsh:Chemistry, 03 medical and health sciences, chemistry.chemical_compound, 0302 clinical medicine, Animals, Humans, Physical and Theoretical Chemistry, Databases, Protein, Molecular Biology, lcsh:QH301-705.5, Spectroscopy, hydrogen bond, Hydrogen bond, mutual synergistic folding, Organic Chemistry, Intermolecular force, Water, solvent-accessible surface area, stabilization center, General Medicine, Ion pairs, intrinsically disordered protein, Computer Science Applications, Folding (chemistry), Intrinsically Disordered Proteins, Protein Subunits, 030104 developmental biology, Monomer, Order (biology), inter-subunit interaction, chemistry, lcsh:Biology (General), lcsh:QD1-999, Biophysics, ion pair, Protein Multimerization, 030217 neurology & neurosurgery

وصف الملف: application/pdf

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::554aaf47f748e96b86490728af187a21Test
https://www.mdpi.com/1422-0067/19/11/3340Test

المؤلفون: José Luis Eugenio Monti, Mariana Rocío Mundo, Gabriela E. Gómez, José M. Delfino

المصدر: Analytical Chemistry. 87:10080-10087

مصطلحات موضوعية: Models, Molecular, Protein Folding, Conformational change, Calmodulin, Protein Conformation, Stereochemistry, Molecular Sequence Data, Methylation, Analytical Chemistry, Accessible surface area, Ciencias Biológicas, chemistry.chemical_compound, Protein structure, Tandem Mass Spectrometry, Footprinting technique, Animals, Organic chemistry, Amino Acid Sequence, Methylene, Binding Sites, biology, Chemistry, Solvent accessible surface area, Bees, Melitten, Biofísica, Diazomethane, Spectrometry, Mass, Matrix-Assisted Laser Desorption-Ionization, Reagent, Diazirine, Solvents, biology.protein, Cattle, Indicators and Reagents, Protein folding, Methane, CIENCIAS NATURALES Y EXACTAS

وصف الملف: application/pdf

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::25da539d80cf594752ee6a921af02664Test
https://doi.org/10.1021/acs.analchem.5b02724Test

المؤلفون: Melo, Rita, Fieldhouse, Robert, Melo, André, Correia, João D G, Cordeiro, Maria Natália D S, Gümüş, Zeynep H, Costa, Joaquim, Bonvin, Alexandre M J J, de Sousa Moreira, Irina, NMR Spectroscopy, Sub NMR Spectroscopy

المساهمون: NMR Spectroscopy, Sub NMR Spectroscopy

المصدر: International Journal of Molecular Sciences
International Journal of Molecular Sciences; Volume 17; Issue 8; Pages: 1215
International Journal of Molecular Sciences, 17(8). MDPI AG
International Journal of Molecular Sciences, Vol 17, Iss 8, p 1215 (2016)

مصطلحات موضوعية: 0301 basic medicine, Normalization (statistics), hot-spots, Interface (Java), Computer science, Protein Conformation, Inference, Machine learning, computer.software_genre, Catalysis, Article, Inorganic Chemistry, lcsh:Chemistry, 03 medical and health sciences, Protein Interaction Mapping, evolutionary sequence conservation, Humans, Protein Interaction Domains and Motifs, Sensitivity (control systems), Physical and Theoretical Chemistry, Databases, Protein, Molecular Biology, lcsh:QH301-705.5, Spectroscopy, Sequence, 030102 biochemistry & molecular biology, business.industry, Organic Chemistry, Solvent Accessible Surface Area (SASA), Computational Biology, Proteins, General Medicine, Function (mathematics), protein-protein interfaces, Computer Science Applications, Random forest, 030104 developmental biology, machine learning, lcsh:Biology (General), lcsh:QD1-999, Test set, Artificial intelligence, business, computer, Algorithms

وصف الملف: application/pdf; image/pdf

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::44a4b11e2f1deb257f2496a0a35d67ccTest