Article
Biochemistry & Molecular Biology
Shan Zhang, Ming Ma, Zhuang Shao, Jincheng Zhang, Lei Fu, Xiangyuan Li, Weihai Fang, Lianghui Gao
Summary: Temporins are a family of antimicrobial peptides isolated from frog skin, which are very short, weakly charged, and highly hydrophobic. They execute bactericidal activities by folding into α-helices at the membrane surface, extracting lipids, and forming protrusions at high peptide concentrations. These unique antimicrobial mechanisms include lipid extraction and tubule-like protrusion formation.
INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES
(2021)
Article
Electrochemistry
ZhangFei Su, Barbara Goodall, J. Jay Leitch, Jacek Lipkowski
Summary: The ion channel properties of gramicidin A in a model floating bilayer lipid membrane were studied, showing that the transport of Na+ across the membrane is independent of the transport of the counterion and the conductivity of the gA sodium channel depends on the transmembrane potential, with more gA molecules inserting into the bilayer as the transmembrane potential decreases.
ELECTROCHIMICA ACTA
(2021)
Article
Multidisciplinary Sciences
Md. Abdul Wadud, Mohammad Abu Sayem Karal, Md. Moniruzzaman, Md. Mamun Or Rashid
Summary: The study investigated the electroporation of cell-mimetic giant unilamellar vesicles (GUVs) in the presence of different membrane potentials. The rate constant of rupture and the probability of rupture were found to significantly increase as the membrane potential increased. The study also provided insights into the pore edge tension and the influence of buffer choice on electroporation kinetics. These findings are valuable for the application of electroporation techniques in the biomedical field.
Article
Biochemistry & Molecular Biology
Yusuke Miyazaki, Wataru Shinoda
Summary: This study investigates the actions of melittin on a lipid membrane through coarse-grained molecular dynamics simulations. Different pore formation modes were observed depending on the peptide concentration and local arrangement, revealing the complexity of melittin's interaction with the membrane.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2022)
Article
Biochemistry & Molecular Biology
Oleg V. Kondrashov, Sergey A. Akimov
Summary: Antimicrobial peptides (AMPs) have potential as antibiotics, but their working concentrations can cause lysis of eukaryotic cells. Gramicidin A (gA) is a highly toxic peptide that forms cation-selective channels. This study proposes using highly-selective amplifiers of AMP activity in target membranes to reduce the working concentrations of AMPs and developed a statistical model to describe the effects of membrane-deforming inclusions on the equilibrium between AMP monomers and cooperative membrane-permeabilizing structures.
INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES
(2022)
Article
Pharmacology & Pharmacy
Yunys Perez-Betancourt, Rachel Zaia, Marina Franchi Evangelista, Rodrigo Tadeu Ribeiro, Bruno Murillo Roncoleta, Beatriz Ideriha Mathiazzi, Ana Maria Carmona-Ribeiro
Summary: Gramicidin nanoparticles and poly(diallyl dimethyl ammonium) chloride water dispersions showed antimicrobial activity against both Gram-positive and Gram-negative bacteria as well as fungi. The combination of gramicidin nanoparticles and poly(diallyl dimethyl ammonium) chloride reduced the required dosage for each component and the activity of gramicidin in lipid bilayers was reduced.
Article
Biochemistry & Molecular Biology
Sung-Tae Yang, Song-Yub Shin, Sung-Heui Shin
Summary: The PXXP motif in PMAP-23 plays a crucial role in its translocation across lipid bilayers by interacting with negatively charged bacterial membranes, and wild-type PMAP-23 has stronger antimicrobial activity compared to its Pro-substituted derivatives.
INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES
(2021)
Article
Biochemistry & Molecular Biology
Maksim A. Kalutsky, Timur R. Galimzyanov, Rodion J. Molotkovsky
Summary: This study investigates the fusion mechanism of monolayer and bilayer membranes during the interaction between lipid droplets and peroxisomes. Through energy trajectory and molecular dynamics simulation, it is found that the stalk formed during the fusion process is energetically more stable and has a lower energy barrier compared to bilayer fusion. The further evolution of the stalk is dependent on the spontaneous curvature of the membrane, possibly related to the incorporation of free fatty acids.
Article
Biophysics
Olivier Soubias, Alexander J. Sodt, Walter E. Teague, Kirk G. Hines, Klaus Gawrisch
Summary: We investigated the influence of cholesterol-induced changes in bilayer thickness on the function of G-protein-coupled receptor (GPCR) rhodopsin. The equilibrium between metarhodopsin-I (MI) and metarhodopsin-II (MII) was monitored using UV-visible spectroscopy, and the ordering of hydrocarbon chains was probed using 2H-NMR. Addition of cholesterol shifted the equilibrium towards MII for thinner bilayers and towards MI for thicker bilayers, and small changes in bilayer thickness within the protein hydrophobic thickness range had drastic effects on MII formation. The interplay between bilayer and protein thickness, induced by cholesterol, resulted in significant swings of the MI-MII equilibrium in membranes of physiological thickness.
BIOPHYSICAL JOURNAL
(2023)
Article
Biochemistry & Molecular Biology
Diana Priyadarshini, Josip Ivica, Frances Separovic, Maurits R. R. de Planque
Summary: Many antimicrobial peptides (AMPs) are cationic host defence peptides (HDPs) that interact with microbial membranes, potentially serving as therapeutics to combat antibiotic resistance. Studying the effects of four AMPs and a bee toxin on different phospholipid membranes highlights the importance of using appropriate bilayer compositions and peptide concentrations for AMP research. The research confirms existing peptide-bilayer interaction models and emphasizes the significance of understanding AMP behavior in relation to lipid bilayers mimicking bacterial and human cell membranes.
BIOPHYSICAL CHEMISTRY
(2022)
Article
Nanoscience & Nanotechnology
Vignesh Udyavara Nagaraj, Tunde Juhasz, Mayra Queme-Pena, Imola Cs Szigyarto, Dora Bogdan, Andras Wacha, Judith Mihaly, Lorand Romanszki, Zoltan Varga, Joakim Andreasson, Istvan Mandity, Tamas Beke-Somfai
Summary: Self-assembled peptide nanostructures with stimuli-responsive features have the potential as functional materials. In this study, a short membrane anchor protein motif was coupled with a spiropyran photoswitch to achieve controllable interactions with lipid membranes. Photo-isomerization triggered rearrangements within the peptide bilayer, resulting in significant changes in their membrane-binding properties.
ACS APPLIED MATERIALS & INTERFACES
(2022)
Article
Chemistry, Multidisciplinary
Jinfeng Wu, Cheng Xu, Zifan Ye, Haibo Chen, Yipeng Wang, Kai Yang, Bing Yuan
Summary: In this study, the membrane-specific action of the antimicrobial peptide As-CATH4 was investigated using a single-lipid tracking method and assays conducted at different scales. It was found that As-CATH4 exhibited potent antimicrobial activity through bacterial membrane permeabilization with moderate cytotoxicity against mammalian cells. Analysis of single lipid diffusion behaviors revealed the dynamic process of As-CATH4 action on the membrane.
Article
Biochemistry & Molecular Biology
Olivia D. Walsh, Leona Choi, Krishna P. Sigdel
Summary: Antimicrobial peptides play a crucial role in the immune system and can affect membrane integrity. This study used atomic force microscopy to investigate the effect of a synthetic hybrid peptide CM15 on the lipid bilayer of E. coli. It was found that CM15 quickly formed membrane-spanning defects and disrupted membrane integrity at high concentrations.
Review
Cell Biology
Muhammad U. Anwar, F. Gisou van der Goot
Summary: S-acylation is an important posttranslational modification that regulates cellular processes. This reversible lipid modification affects cellular pathways and physiological processes, and the enzymes and proteins involved in S-acylation are still being discovered and studied.
JOURNAL OF CELL BIOLOGY
(2023)
Article
Biochemical Research Methods
Nandan Kumar, G. Narahari Sastry
Summary: This study investigates the composition and structure-function relationships of lipids in human cell membranes. It was found that membranes enriched with cholesterol exhibit increased compactness and thickness.
JOURNAL OF MOLECULAR GRAPHICS & MODELLING
(2021)
Article
Neurosciences
Trine Lisberg Toft-Bertelsen, Brian Roland Larsen, Sofie Kjellerup Christensen, Himanshu Khandelia, Helle S. Waagepetersen, Nanna MacAulay
Summary: The compound TGN-020 is shown to be an effective selective AQP4 inhibitor with high selectivity for AQP4, but no inhibitory effect on other AQPs (AQP1-AQP9).
Article
Chemistry, Applied
Charlotte Vinther Schmidt, Karsten Olsen, Ole G. Mouritsen
Summary: The study measured the FAA contents of selected fermented beverages using UHPLC and found that sakes, beers, wines, and champagnes with long yeast contact contain significant amounts of free glutamate. The results suggest that combining these fermented beverages with food rich in free nucleotides can achieve umami synergy.
Article
Chemistry, Medicinal
Saki Tanaka, Mikio Morita, Tatsuya Yamagishi, Hridya Valia Madapally, Kenichi Hayashida, Himanshu Khandelia, Christoph Gerle, Hideki Shigematsu, Atsunori Oshima, Kazuhiro Abe
Summary: This study provides crystal and cryo-EM structures of the gastric proton pump in complex with four different P-CABs, revealing the molecular details of their interactions and a novel binding mode. The findings will contribute to the rational development and improvement of P-CABs for better treatment of acid-related gastrointestinal diseases.
JOURNAL OF MEDICINAL CHEMISTRY
(2022)
Article
Biochemistry & Molecular Biology
Teresa Quynh Tram Nguyen, Frederik Wendelboe Lund, Ali Asghar Hakami Zanjani, Himanshu Khandelia
Summary: The active hallucinogen psilocin is being repurposed to treat nicotine addiction and treatment-resistant depression. Recent evidence suggests that psilocin may exert its effects through a membrane-mediated receptor-binding mechanism. Both psilocin and serotonin have similar impacts on lipid membranes, but psilocin's effect is limited by its chemical structure.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2022)
Article
Chemistry, Physical
Mayank Prakash Pandey, Sreeja Sasidharan, Velayudhan A. Raghunathan, Himanshu Khandelia
Summary: Hydrotropes are compounds that increase the solubility of hydrophobic molecules in water. Recent evidence shows that adenosine triphosphate (ATP), the primary energy carrier in cells, also exhibits hydrotropic properties. In this study, molecular dynamics simulations were used to compare the hydrotropic behavior of four biological nucleoside triphosphates (NTPs). The results suggest that guanosine triphosphate (GTP) has a higher hydrotropic efficiency compared to ATP.
JOURNAL OF PHYSICAL CHEMISTRY B
(2022)
Review
Food Science & Technology
Charlotte Vinther Schmidt, Ole G. Mouritsen
Summary: Foods are complex systems with hierarchical structures that influence texture and taste. Cephalopods, known for their challenging texture, are rich in compounds that elicit umami taste. Scientific investigations of cephalopods as foods require mechanical studies, physicochemical measurements, and chemical analysis. The combination of basic science and exploration of gastronomic potential is called gastrophysics.
Article
Multidisciplinary Sciences
Anna Mularski, Stine Lauritzen Sonder, Anne Sofie Busk Heitmann, Mayank Prakash Pandey, Himanshu Khandelia, Jesper Nylandsted, Adam Cohen Simonsen
Summary: In this study, the effect of different crosslinking annexins on membrane curvature induction was investigated in a model membrane system. The results support a mechanistic model of plasma membrane repair, where ANXA4 induces membrane curvature and ANXA6 crosslinking promotes wound closure. Additionally, it was found that ANXA1 and ANXA2, as specialist free edge membrane crosslinkers, also play a role in this mechanism.
SCIENTIFIC REPORTS
(2022)
Article
Biophysics
Ali Asghar Hakami Zanjani, Anna Mularski, Anne Sofie Busk Heitmann, Catarina Dias, Michelle Ege Moller, Kenji Maeda, Jesper Nylandsted, Adam Cohen Simonsen, Himanshu Khandelia
Summary: Using molecular dynamics simulations, the study reverse engineered an ANXA3-mutant that can trimerize on the membrane surface and induce high curvature, similar to ANXA4. However, despite its trimer-forming and curvature-inducing properties, the engineered ANXA3 does not accumulate near a membrane lesion and is unable to repair the lesion. These findings provide insights into the factors driving annexin-mediated membrane repair and highlight the importance of high membrane binding affinity in addition to trimer formation and induction of negative membrane curvature.
BIOPHYSICAL JOURNAL
(2023)
Article
Biochemistry & Molecular Biology
Fateme Zohairi, Himanshu Khandelia, Ali Asghar Hakami Zanjani
Summary: Naturally occurring psychedelics have been used for various purposes, including remedies, religious ceremonies, and recreational activities. Recent studies have demonstrated the therapeutic potential of certain psychedelic compounds in treating anxiety, depression, migraine, and addiction. This research focuses on the impact of different tryptamine class compounds on a model bilayer lipid membrane and reveals how their chemical structure affects partitioning and passage across the membrane.
CHEMISTRY AND PHYSICS OF LIPIDS
(2023)
Review
Biotechnology & Applied Microbiology
J. L. Perez-Llorens, A. T. Critchley, M. L. Cornish, O. G. Mouritsen
Summary: The benefits of various seaweeds have long been recognized by humans, especially by coastal dwellers and those who use seaweeds as food and medicine. Their positive effects are likely due to the presence of hydrocolloids and bioactive compounds. This compilation of excerpts from major medical publications and esteemed writers provides a rich background supporting the positive applications of seaweeds for various human ailments.
JOURNAL OF APPLIED PHYCOLOGY
(2023)
Article
Food Science & Technology
Ole G. Mouritsen
Summary: Roe refers to the eggs or whole gonads of fish, crustaceans, mollusks, and echinoderms. It is not only a source of nutrients for animals in the sea, but also a popular food among humans. From cod roe to caviar, roe is consumed in various forms and holds a rich gastronomic history. With its high omega-3 fatty acid content and unique taste, roe is valued for its nutrition and culinary uses. This article explores the diverse types of roe beyond sturgeon, such as flat fish, codfish, mullet, smelt, trout, herring, crab, shrimp, and octopus, as well as caviar substitutes made from fish meat and seaweeds. It argues for the sustainable and creative use of roe, including enhancing the umami flavor of vegetable and green dishes.
INTERNATIONAL JOURNAL OF GASTRONOMY AND FOOD SCIENCE
(2023)
Letter
Food Science & Technology
Ole G. Mouritsen
Article
Biochemistry & Molecular Biology
Ali Asghar Hakami Zanjani, Teresa Quynh Tram Nguyen, Luise Jacobsen, Himanshu Khandelia
Summary: This study investigates the structure and mechanism of action of psilocybin, an active compound in magic mushrooms. It is found that psilocybin has higher affinity for the 5-HT2A receptor compared to serotonin, and design rules for effective antidepressants are proposed based on molecular insights from simulations.
BIOCHIMICA ET BIOPHYSICA ACTA-PROTEINS AND PROTEOMICS
(2023)
Article
Chemistry, Physical
Judith Kuntsche, Kirishana Rajakulendran, Hibo Mohamed Takane Sabriye, Navidullah Tawakal, Himanshu Khandelia, Ali Asghar Hakami Zanjani
Summary: The release behavior of hydrophobic porphyrins mTHPP and pTHPP from liposomes is influenced by their minor structural differences. Results show that mTHPP is more hydrophobic and redistributes slower to the acceptor phases compared to pTHPP. Molecular dynamics simulations explain that mTHPP forms stronger hydrogen bonds with the lipid head groups and is embedded deeper in the membrane.
JOURNAL OF COLLOID AND INTERFACE SCIENCE
(2023)
Meeting Abstract
Biophysics
Mayank P. Pandey, Weria Pezeshkian, Himanshu Khandelia
BIOPHYSICAL JOURNAL
(2023)
Article
Biochemistry & Molecular Biology
Philipp Grad, Katarina Edwards, Lars Gedda, Victor Agmo Hernandez
Summary: This study investigates the effects of polyethylene glycol-(PEG) modified lipids and gangliosides on the Ca2+ induced interaction between liposomes composed of palmitoyl-oleoyl phosphatidylethanolamine (POPE) and palmitoyl-oleoyl phosphatidylserine (POPS) at physiological ionic strength. The results show that naked liposomes tend to adhere, rupture, and collapse on each other's surfaces upon addition of Ca2+, eventually resulting in the formation of large multilamellar aggregates and bilayer sheets. However, the presence of gangliosides or PEGylated lipids leads to the formation of small, long-lived bilayer fragments/disks. PEGylated lipids seem to be more effective than gangliosides at stabilizing these structures. The study suggests that direct liposome-liposome fusion is not the dominating process triggered by Ca2+ in the systems studied.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Article
Biochemistry & Molecular Biology
Saurabh Saraswat, Archana Chugh
Summary: Cell penetrating peptides (CPP) are important tools for intracellular delivery of molecules. In this study, a novel marine-derived CPP from Engraulis japonicus, called Engraulisin, was reported. Engraulisin demonstrated successful cellular uptake and selective antimicrobial activity against Methicillin-resistant Staphylococcus aureus (MRSA), making it a potential candidate for drug delivery.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Article
Biochemistry & Molecular Biology
Emanuela Efodili, Ashlynn Knight, Maryem Mirza, Cedric Briones, Il-Hyung Lee
Summary: This study demonstrates the spontaneous transfer of small membrane-bound peptides between a supported lipid bilayer and giant unilamellar vesicles in vitro. The transfer occurs through the formation of hemi-fusion stalks and is limited to small peptides due to the highly curved structure of the stalk. This system provides a synthetic platform for studying peptide trafficking between synthetic membranes.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Article
Biochemistry & Molecular Biology
Yueqi Niu, Si Jia Chen, Jeffery B. Klauda
Summary: Macrophage membranes in the activated state are more tightly packed, exhibit increased chain order across lipid species, and form specific lipid clusters. These findings provide physiologically accurate models for future computational studies of macrophage membranes and their proteins.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Article
Biochemistry & Molecular Biology
Niki Baccile, Vincent Chaleix, Ingo Hoffmann
Summary: This study measured the bending rigidity of self-assembled structures formed by a new biobased glucolipid bioamphiphile using neutron spin-echo (NSE) technology. The results showed that the bending rigidity of these structures is lower or higher compared to phospholipid membranes, providing a new theoretical basis for the application of these new molecular systems.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Article
Biochemistry & Molecular Biology
Alain Bolano Alvares, Pablo E. A. Rodriguez, Gerardo D. Fidelio
Summary: The behavior of amphiphilic molecules at the air/water interface was studied to evaluate the arrangement formed in a confined area. The surface properties of zwitterionic DPPC lipid and A beta(1-40) amyloid peptide in mixed films were investigated at different temperatures. DPPC undergoes a phase transition depending on temperature and lateral pressure, which allows for the study of its influence on amyloid structure formation.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Article
Biochemistry & Molecular Biology
Lukasz Plachta, Marzena Mach, Magdalena Kowalska, Pawel Wydro
Summary: Resveratrol, a popular phytoalexin found in grapes and red wine, has beneficial effects on the cardiovascular system, exhibits antiviral, antibacterial, and antifungal properties, and may have therapeutic effects against cancer. This study investigates the interaction of resveratrol with model cell membranes, demonstrating changes in their physicochemical parameters and highlighting the role of cholesterol content in resveratrol incorporation. The findings suggest that the molecular mechanism of action of resveratrol may involve interactions with lipid rafts.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Article
Biochemistry & Molecular Biology
Edurne Rujas, Beatriz Apellaniz, Johana Torralba, David Andreu, Jose M. M. Caaveiro, Shixia Wang, Shan Lu, Jose L. Nieva
Summary: This study investigates the role of fusion peptide and Trp-rich membrane proximal external region in HIV-1 fusion and demonstrates that liposome-based formulations containing FP-MPER hybrid peptides can induce the production of specific neutralizing antibodies in rabbits. The results support the use of liposomes as vaccine carriers and the inclusion of lipid membranes in immunogens to elicit specific humoral responses.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Article
Biochemistry & Molecular Biology
Dailin Li, Dingyuan Shi, Lei Wang
Summary: G protein-gated inwardly rectifying potassium (GIRK) channels play a significant role in regulating cell excitability. This study investigated the ion permeation mechanism in GIRK2 mutants using molecular dynamic simulations and QM/MM methods. The results revealed the importance of a multi-ion distribution for ion conduction.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Article
Biochemistry & Molecular Biology
Max J. den Uijl, Arnold J. M. Driessen
Summary: Membrane protein insertion into and translocation across the bacterial cytoplasmic membrane are essential processes facilitated by the Sec translocon. The phospholipid dependence of membrane protein insertion has remained mostly unknown. This study reveals that the insertion of the mannitol permease MtlA into the membrane depends on the presence of phosphatidylglycerol and is stimulated by phosphatidylethanolamine.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Article
Biochemistry & Molecular Biology
Patrick Allen, Adam C. Smith, Vernon Benedicto, Abbas Abdulhasan, Vasanthy Narayanaswami, Enrico Tapavicza
Summary: We explore the stability, size, and structure of nanodiscs formed by the N-terminal domain of apolipoprotein E3 and a variable number of 1,2-dimyristoyl-sn-glycero-3-phosphocholine molecules. Our simulations suggest that nanodiscs containing 240 to 420 DMPC molecules are stable. The antiparallel configuration shows more protein-protein interactions and ionic contacts, as well as greater stability and rigidity compared to the parallel configuration.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Article
Biochemistry & Molecular Biology
Patrick M. Keating, Nicholas P. Schifano, Xinrui Wei, Matthew Y. Kong, Jinwoo Lee
Summary: Lassa virus (LASV) infection is dependent on the fusion of its viral membrane with the host cell membrane, and our study reveals that this fusion process involves pH-dependent conformational changes in the transmembrane domain of LASV. These findings provide valuable insights into the fusion mechanism of LASV and can be utilized in the design of therapeutics to combat Lassa virus infections and prevent its potential spread.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Article
Biochemistry & Molecular Biology
Ashley L. Bennett, Kristen N. Cranford, Austin L. Bates, Christopher R. Sabatini, Hee-Seung Lee
Summary: This study employed molecular dynamics simulations to elucidate the binding, folding, and insertion details of TP10W in the cell membrane. The simulations revealed that TP10W can translocate across the lipid membrane as a monomer, and the charged amino acid side chains can move between lipid leaflets. Comparison with point mutated variants demonstrated significant conformational changes due to charge distribution.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Article
Biochemistry & Molecular Biology
Jessica H. van Wonderen, Jason C. Crack, Marcus J. Edwards, Thomas A. Clarke, Gerhard Saalbach, Carlo Martins, Julea N. Butt
Summary: Electrogenic bacteria transfer excess respiratory electrons to metal oxide particles and electrodes through the MtrCAB complex. The crystal structure of MtrCAB from S. baltica OS185 was resolved, and liquid chromatography mass spectrometry was used to determine the mass values of the three proteins in purified MtrCAB complexes.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
Review
Biochemistry & Molecular Biology
Yi-Ming Chen, Ching-Tai Lu, Chia-Wen Wang, Wolfgang B. Fischer
Summary: A series of dye ligands were ranked based on docking experiments, selecting the most suitable ligands for binding with different proteins. Additionally, a comparison study was conducted on a series of repurposing drugs and known antivirals.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES
(2024)
