Ilpo Vattulainen
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Physics
Ilpo Vattulainen's Degrees
- PhD Physics University of Helsinki
- Masters Physics University of Helsinki
- Bachelors Physics University of Helsinki
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(Suggest an Edit or Addition)Ilpo Vattulainen's Published Works
Published Works
- Molecular lipidomics of exosomes released by PC-3 prostate cancer cells. (2013) (532)
- Ordering effects of cholesterol and its analogues. (2009) (487)
- Molecular dynamics simulations of lipid bilayers: major artifacts due to truncating electrostatic interactions. (2002) (350)
- Under the influence of alcohol: the effect of ethanol and methanol on lipid bilayers. (2004) (318)
- Martini 3: a general purpose force field for coarse-grained molecular dynamics (2021) (269)
- Assessing the Nature of Lipid Raft Membranes (2007) (262)
- Lessons of slicing membranes: interplay of packing, free area, and lateral diffusion in phospholipid/cholesterol bilayers. (2004) (253)
- Multiscale modeling of emergent materials: biological and soft matter. (2009) (247)
- BODIPY‐Cholesterol: A New Tool to Visualize Sterol Trafficking in Living Cells and Organisms (2008) (231)
- Association of Lipidome Remodeling in the Adipocyte Membrane with Acquired Obesity in Humans (2011) (221)
- Effect of NaCl and KCl on phosphatidylcholine and phosphatidylethanolamine lipid membranes: insight from atomic-scale simulations for understanding salt-induced effects in the plasma membrane. (2008) (207)
- Antidepressant drugs act by directly binding to TRKB neurotrophin receptors (2019) (194)
- Coarse-graining polymers with the MARTINI force-field: polystyrene as a benchmark case (2011) (190)
- Cholesterol modulates glycolipid conformation and receptor activity. (2011) (189)
- Integration schemes for dissipative particle dynamics simulations: From softly interacting systems towards hybrid models (2002) (175)
- Polyunsaturation in lipid membranes: dynamic properties and lateral pressure profiles. (2007) (175)
- Protein Crowding in Lipid Bilayers Gives Rise to Non-Gaussian Anomalous Lateral Diffusion of Phospholipids and Proteins (2016) (171)
- Pore formation coupled to ion transport through lipid membranes as induced by transmembrane ionic charge imbalance: atomistic molecular dynamics study. (2005) (170)
- 3D pressure field in lipid membranes and membrane-protein complexes. (2009) (168)
- Defect-mediated trafficking across cell membranes: insights from in silico modeling. (2010) (166)
- The hydrophobic effect and its role in cold denaturation. (2010) (165)
- Lipid Bilayers Driven to a Wrong Lane in Molecular Dynamics Simulations by Subtle Changes in Long-Range Electrostatic Interactions (2004) (161)
- Atomic-scale structure and electrostatics of anionic palmitoyloleoylphosphatidylglycerol lipid bilayers with Na+ counterions. (2007) (155)
- Membrane proteins diffuse as dynamic complexes with lipids. (2010) (154)
- Structure and dynamics of sphingomyelin bilayer: insight gained through systematic comparison to phosphatidylcholine. (2004) (154)
- Anomalous and normal diffusion of proteins and lipids in crowded lipid membranes. (2013) (152)
- Multiscale Simulations of Biological Membranes: The Challenge To Understand Biological Phenomena in a Living Substance (2019) (151)
- Cholesterol, sphingolipids, and glycolipids: what do we know about their role in raft-like membranes? (2014) (146)
- Lateral sorting in model membranes by cholesterol-mediated hydrophobic matching (2011) (141)
- Lateral diffusion in lipid membranes through collective flows. (2008) (140)
- Cationic DMPC/DMTAP lipid bilayers: molecular dynamics study. (2003) (136)
- How would you integrate the equations of motion in dissipative particle dynamics simulations (2003) (136)
- Refined OPLS all-atom force field for saturated phosphatidylcholine bilayers at full hydration. (2014) (129)
- Molecular mechanism for lipid flip-flops. (2007) (129)
- Insight into the putative specific interactions between cholesterol, sphingomyelin, and palmitoyl-oleoyl phosphatidylcholine. (2007) (125)
- Cholesterol oxidation products and their biological importance. (2016) (125)
- Analysis of twisting of cellulose nanofibrils in atomistic molecular dynamics simulations. (2011) (122)
- N-Glycosylation as determinant of epidermal growth factor receptor conformation in membranes (2015) (120)
- Interplay of unsaturated phospholipids and cholesterol in membranes: effect of the double-bond position. (2008) (120)
- Composition and lipid spatial distribution of HDL particles in subjects with low and high HDL-cholesterol[S] (2010) (118)
- Coarse-grained model for phospholipid/cholesterol bilayer. (2004) (116)
- Conformational Changes and Slow Dynamics through Microsecond Polarized Atomistic Molecular Simulation of an Integral Kv1.2 Ion Channel (2009) (115)
- Excessive aggregation of membrane proteins in the Martini model (2017) (113)
- Cholesterol Induces Specific Spatial and Orientational Order in Cholesterol/Phospholipid Membranes (2010) (112)
- Effects of carbon nanoparticles on lipid membranes: a molecular simulation perspective (2009) (110)
- Role of sterol type on lateral pressure profiles of lipid membranes affecting membrane protein functionality: Comparison between cholesterol, desmosterol, 7-dehydrocholesterol and ketosterol. (2007) (109)
- Tilt: major factor in sterols' ordering capability in membranes. (2006) (108)
- Reptational dynamics in dissipative particle dynamics simulations of polymer melts. (2005) (107)
- Influence of DPH on the structure and dynamics of a DPPC bilayer. (2005) (107)
- Microscopic mechanism for cold denaturation. (2007) (105)
- Role of Lipids in Spheroidal High Density Lipoproteins (2010) (103)
- Influence of chain length and unsaturation on sphingomyelin bilayers. (2006) (103)
- Ion leakage through transient water pores in protein-free lipid membranes driven by transmembrane ionic charge imbalance. (2007) (100)
- Redox-induced activation of the proton pump in the respiratory complex I (2015) (99)
- Role of phosphatidylglycerols in the stability of bacterial membranes. (2008) (98)
- Membrane potential and electrostatics of phospholipid bilayers with asymmetric transmembrane distribution of anionic lipids. (2008) (96)
- Significance of Sterol Structural Specificity (2006) (95)
- Mechanism of allosteric regulation of β2-adrenergic receptor by cholesterol (2016) (93)
- Influence of ethanol on lipid membranes: from lateral pressure profiles to dynamics and partitioning. (2008) (93)
- What happens if cholesterol is made smoother: importance of methyl substituents in cholesterol ring structure on phosphatidylcholine-sterol interaction. (2007) (92)
- On Coarse-Graining by the Inverse Monte Carlo Method: Dissipative Particle Dynamics Simulations Made to a Precise Tool in Soft Matter Modeling (2002) (89)
- Concerted diffusion of lipids in raft-like membranes. (2010) (87)
- Impact of cholesterol on voids in phospholipid membranes. (2004) (86)
- Novel Methods in Soft Matter Simulations (2013) (84)
- An efficient auxin-inducible degron system with low basal degradation in human cells (2019) (84)
- Atomistic Simulations of Functional Au144(SR)60 Gold Nanoparticles in Aqueous Environment (2012) (83)
- Mechanistic principles underlying regulation of the actin cytoskeleton by phosphoinositides (2017) (83)
- Distribution, Orientation, and Dynamics of DPH Probes in DPPC Bilayer (2004) (82)
- Structure of spheroidal HDL particles revealed by combined atomistic and coarse-grained simulations. (2008) (81)
- Mechanism of homodimeric cytokine receptor activation and dysregulation by oncogenic mutations (2020) (79)
- Molecular organization of the tear fluid lipid layer. (2010) (77)
- Effect of sphingomyelin headgroup size on molecular properties and interactions with cholesterol. (2010) (77)
- Interdigitation of long-chain sphingomyelin induces coupling of membrane leaflets in a cholesterol dependent manner. (2016) (75)
- Cationic Au Nanoparticle Binding with Plasma Membrane-like Lipid Bilayers: Potential Mechanism for Spontaneous Permeation to Cells Revealed by Atomistic Simulations (2014) (75)
- Lipid transmembrane asymmetry and intrinsic membrane potential: two sides of the same coin. (2007) (75)
- Atom-scale molecular interactions in lipid raft mixtures. (2009) (73)
- Free Volume Properties of Sphingomyelin, DMPC, DPPC, and PLPC Bilayers (2005) (73)
- Mechanism for translocation of fluoroquinolones across lipid membranes. (2012) (72)
- Redox-coupled quinone dynamics in the respiratory complex I (2018) (70)
- Nanoscale Membrane Domain Formation Driven by Cholesterol (2017) (69)
- Calculation of the electrostatic potential of lipid bilayers from molecular dynamics simulations: methodological issues. (2009) (66)
- Replacing the cholesterol hydroxyl group with the ketone group facilitates sterol flip-flop and promotes membrane fluidity. (2008) (65)
- Mechanism of synergistic actin filament pointed end depolymerization by cyclase-associated protein and cofilin (2019) (65)
- A MARTINI Coarse-Grained Model of a Thermoset Polyester Coating (2011) (65)
- Electrostatics in Biomolecular Simulations: Where Are We Now and Where Are We Heading? (2008) (65)
- Structural effects of small molecules on phospholipid bilayers investigated by molecular simulations (2004) (65)
- Coarse-grained model for phospholipid/cholesterol bilayer employing inverse Monte Carlo with thermodynamic constraints. (2007) (65)
- Influence of pyrene-labeling on fluid lipid membranes. (2006) (64)
- Cryo-EM structure of the complete and ligand-saturated insulin receptor ectodomain (2019) (63)
- Strain hardening, avalanches, and strain softening in dense cross-linked actin networks. (2008) (63)
- Calcium Directly Regulates Phosphatidylinositol 4,5-Bisphosphate Headgroup Conformation and Recognition (2017) (63)
- Glycolipid membranes through atomistic simulations: effect of glucose and galactose head groups on lipid bilayer properties. (2007) (62)
- A comparative study of some pseudorandom number generators (1993) (59)
- Diffusion of Integral Membrane Proteins in Protein-Rich Membranes. (2017) (59)
- Role of glycolipids in lipid rafts: a view through atomistic molecular dynamics simulations with galactosylceramide. (2010) (59)
- Cholesterol under oxidative stress-How lipid membranes sense oxidation as cholesterol is being replaced by oxysterols. (2015) (59)
- Role of charged lipids in membrane structures - Insight given by simulations. (2016) (59)
- Effect of monovalent salt on cationic lipid membranes as revealed by molecular dynamics simulations. (2005) (58)
- How to tackle the issues in free energy simulations of long amphiphiles interacting with lipid membranes: convergence and local membrane deformations. (2014) (58)
- Effect of kinks and concerted diffusion mechanisms on mass transport and growth on stepped metal surfaces (1997) (58)
- Role of cardiolipins in the inner mitochondrial membrane: insight gained through atom-scale simulations. (2009) (57)
- Do lipids retard the evaporation of the tear fluid? (2012) (55)
- Systematic coarse graining from structure using internal states: application to phospholipid/cholesterol bilayer. (2009) (55)
- Effect of double bond position on lipid bilayer properties: insight through atomistic simulations. (2007) (54)
- doGlycans–Tools for Preparing Carbohydrate Structures for Atomistic Simulations of Glycoproteins, Glycolipids, and Carbohydrate Polymers for GROMACS (2017) (54)
- Structural basis of actin monomer re-charging by cyclase-associated protein (2018) (54)
- Molecular dynamics study of charged dendrimers in salt-free solution: effect of counterions. (2005) (54)
- Low density lipoprotein: structure, dynamics, and interactions of apoB-100 with lipids (2011) (53)
- Significance of cholesterol methyl groups. (2008) (53)
- Atomistic simulations indicate cardiolipin to have an integral role in the structure of the cytochrome bc1 complex. (2013) (53)
- Diffusion in Membranes (2005) (52)
- Proton-coupled electron transfer and the role of water molecules in proton pumping by cytochrome c oxidase (2015) (52)
- Lipid Exchange Mechanism of the Cholesteryl Ester Transfer Protein Clarified by Atomistic and Coarse-grained Simulations (2012) (51)
- Key steps in unconventional secretion of fibroblast growth factor 2 reconstituted with purified components (2017) (51)
- Influence of cis double-bond parametrization on lipid membrane properties: how seemingly insignificant details in force-field change even qualitative trends. (2008) (50)
- Modeling of the triglyceride-rich core in lipoprotein particles. (2008) (50)
- Free pyrene probes in gel and fluid membranes: perspective through atomistic simulations. (2007) (49)
- Real-time translocation of fullerene reveals cell contraction. (2008) (49)
- Atomistic simulations of anionic Au144(SR)60 nanoparticles interacting with asymmetric model lipid membranes. (2014) (48)
- Protein shape change has a major effect on the gating energy of a mechanosensitive channel. (2011) (48)
- High Density Lipoprotein Structural Changes and Drug Response in Lipidomic Profiles following the Long-Term Fenofibrate Therapy in the FIELD Substudy (2011) (48)
- Enzymatic Oxidation of Cholesterol: Properties and Functional Effects of Cholestenone in Cell Membranes (2014) (47)
- Strong preferences of dopamine and l‐dopa towards lipid head group: importance of lipid composition and implication for neurotransmitter metabolism (2012) (47)
- Comparison of cholesterol and its direct precursors along the biosynthetic pathway: effects of cholesterol, desmosterol and 7-dehydrocholesterol on saturated and unsaturated lipid bilayers. (2008) (45)
- Atomistic Model for Nearly Quantitative Simulations of Langmuir Monolayers. (2017) (45)
- Lessons from the biophysics of interfaces: Lung surfactant and tear fluid (2011) (45)
- The impact of lipid composition on the stability of the tear fluid lipid layer (2012) (45)
- How well does cholesteryl hemisuccinate mimic cholesterol in saturated phospholipid bilayers? (2014) (44)
- Sec14-nodulin proteins and the patterning of phosphoinositide landmarks for developmental control of membrane morphogenesis (2015) (43)
- Influence of hydrodynamics on many-particle diffusion in 2D colloidal suspensions (2003) (43)
- Experimental determination and computational interpretation of biophysical properties of lipid bilayers enriched by cholesteryl hemisuccinate. (2015) (42)
- Interfacial tension and surface pressure of high density lipoprotein, low density lipoprotein, and related lipid droplets. (2012) (40)
- Adatom dynamics and diffusion in a model of O/W(110) (1998) (39)
- PEGylated Liposomes as Carriers of Hydrophobic Porphyrins. (2015) (38)
- Transient ordered domains in single-component phospholipid bilayers. (2006) (38)
- Complexes Comprised of Charged Dendrimers, Linear Polyelectrolytes, and Counterions: Insight through Coarse-Grained Molecular Dynamics Simulations (2008) (38)
- Long-range interactions and parallel scalability in molecular simulations (2004) (38)
- Assessment of mutation probabilities of KRAS G12 missense mutants and their long-timescale dynamics by atomistic molecular simulations and Markov state modeling (2018) (38)
- Distribution and dynamics of quinones in the lipid bilayer mimicking the inner membrane of mitochondria. (2016) (37)
- Free volume theory applied to lateral diffusion in Langmuir monolayers: atomistic simulations for a protein-free model of lung surfactant. (2010) (37)
- Effects of DPH on DPPC-cholesterol membranes with varying concentrations of cholesterol: from local perturbations to limitations in fluorescence anisotropy experiments. (2010) (37)
- Key role of water in proton transfer at the Qo-site of the cytochrome bc1 complex predicted by atomistic molecular dynamics simulations. (2013) (37)
- Ion dynamics in cationic lipid bilayer systems in saline solutions. (2009) (36)
- N- and O-methylation of sphingomyelin markedly affects its membrane properties and interactions with cholesterol. (2011) (36)
- Mitochondrial membranes with mono- and divalent salt: changes induced by salt ions on structure and dynamics. (2009) (36)
- Lipid simulations: a perspective on lipids in action. (2011) (36)
- Molecular dynamics simulations reveal fundamental role of water as factor determining affinity of binding of beta-blocker nebivolol to beta(2)-adrenergic receptor. (2010) (35)
- The challenges of understanding glycolipid functions: An open outlook based on molecular simulations. (2014) (35)
- Dielectrophoresis of nanocolloids: A molecular dynamics study (2005) (34)
- Atomistic simulations of phosphatidylcholines and cholesteryl esters in high-density lipoprotein-sized lipid droplet and trilayer: clues to cholesteryl ester transport and storage. (2009) (34)
- Mechanical properties of cellulose nanofibrils determined through atomistic molecular dynamics simulations (2012) (33)
- Selective effect of cell membrane on synaptic neurotransmission (2016) (33)
- Asymmetric nature of lateral pressure profiles in supported lipid membranes and its implications for membrane protein functions (2009) (33)
- Dynamics and scaling of two-dimensional polymers in a dilute solution. (2003) (32)
- Interaction of hematoporphyrin with lipid membranes. (2012) (32)
- Seipin traps triacylglycerols to facilitate their nanoscale clustering in the endoplasmic reticulum membrane. (2021) (32)
- Phase Partitioning of GM1 and Its Bodipy-Labeled Analog Determine Their Different Binding to Cholera Toxin (2017) (30)
- Memory effects and coverage dependence of surface diffusion in a model adsorption system (1999) (30)
- Non-Arrhenius Behavior of Surface Diffusion near a Phase Transition Boundary (1997) (30)
- Lipid domain morphologies in phosphatidylcholine-ceramide monolayers. (2009) (29)
- Atomistic simulation studies of cholesteryl oleates: model for the core of lipoprotein particles. (2006) (28)
- The Role of Temperature and Lipid Charge on Intake/Uptake of Cationic Gold Nanoparticles into Lipid Bilayers. (2019) (28)
- Atomistic fingerprint of hyaluronan–CD44 binding (2017) (28)
- Role of subunit III and its lipids in the molecular mechanism of cytochrome c oxidase. (2015) (27)
- The role of hydrophobic matching on transmembrane helix packing in cells (2017) (27)
- Understanding the Role of Lipids in Signaling Through Atomistic and Multiscale Simulations of Cell Membranes. (2019) (27)
- Modeling Lipid-Sterol Bilayers: Applications to Structural Evolution, Lateral Diffusion, and Rafts (2004) (26)
- Exploring the effect of xenon on biomembranes. (2005) (26)
- How cardiolipin peroxidation alters the properties of the inner mitochondrial membrane? (2018) (26)
- Probing biomembranes with positrons. (2009) (26)
- Role of neutral lipids in tear fluid lipid layer: coarse-grained simulation study. (2012) (26)
- Simulation study of lateral diffusion in lipid-sterol bilayer mixtures (2001) (26)
- Response to comment by Almeida et al.: free area theories for lipid bilayers--predictive or not? (2005) (26)
- Memory expansion for diffusion coefficients (1998) (26)
- Molecular mechanisms of Charcot-Marie-Tooth neuropathy linked to mutations in human myelin protein P2 (2017) (26)
- PIP2 and Talin Join Forces to Activate Integrin. (2015) (25)
- Glucosylceramide modifies the LPS-induced inflammatory response in macrophages and the orientation of the LPS/TLR4 complex in silico (2018) (25)
- Modeling glycolipids: take one. (2005) (25)
- How to minimize dye-induced perturbations while studying biomembrane structure and dynamics: PEG linkers as a rational alternative. (2018) (24)
- Chapter 2:Lateral Pressure Profiles in Lipid Membranes: Dependence on Molecular Composition (2010) (24)
- Concerted regulation of npc2 binding to endosomal/lysosomal membranes by bis(monoacylglycero)phosphate and sphingomyelin (2017) (24)
- Why is the sn-2 chain of monounsaturated glycerophospholipids usually unsaturated whereas the sn-1 chain is saturated? Studies of 1-stearoyl-2-oleoyl-sn-glycero-3-phosphatidylcholine (SOPC) and 1-oleoyl-2-stearoyl-sn-glycero-3-phosphatidylcholine (OSPC) membranes with and without cholesterol. (2009) (23)
- Intrinsic potential of cell membranes: opposite effects of lipid transmembrane asymmetry and asymmetric salt ion distribution. (2009) (23)
- How endoglucanase enzymes act on cellulose nanofibrils: role of amorphous regions revealed by atomistic simulations (2015) (23)
- Cationic dimyristoylphosphatidylcholine and dioleoyloxytrimethylammonium propane lipid bilayers: atomistic insight for structure and dynamics. (2012) (23)
- Parameterization of the prosthetic redox centers of the bacterial cytochrome bc1 complex for atomistic molecular dynamics simulations (2013) (23)
- Effect of PEGylation on drug entry into lipid bilayer. (2014) (22)
- The Integrin Receptor in Biologically Relevant Bilayers: Insights from Molecular Dynamics Simulations (2016) (22)
- Interaction of fusidic acid with lipid membranes: Implications to the mechanism of antibiotic activity. (2006) (22)
- Mission Impossible: Find a Random Pseudorandom Number Generator (1995) (21)
- Mutually Exclusive Roles of SHARPIN in Integrin Inactivation and NF-κB Signaling (2015) (21)
- Ionic cloud distribution close to a charged surface in the presence of salt (2007) (21)
- Conformational analysis of lipid molecules by self-organizing maps. (2007) (21)
- Ceramide-1-phosphate, in contrast to ceramide, is not segregated into lateral lipid domains in phosphatidylcholine bilayers. (2009) (20)
- A Ceramide-Regulated Element in the Late Endosomal Protein LAPTM4B Controls Amino Acid Transporter Interaction (2018) (20)
- Bobbing of Oxysterols: Molecular Mechanism for Translocation of Tail-Oxidized Sterols through Biological Membranes. (2018) (20)
- Properties of the membrane binding component of catechol-O-methyltransferase revealed by atomistic molecular dynamics simulations. (2011) (19)
- Tracer diffusion in colloidal suspensions under dilute and crowded conditions with hydrodynamic interactions. (2012) (19)
- Glycosylation and Lipids Working in Concert Direct CD2 Ectodomain Orientation and Presentation (2017) (19)
- Dynamics and energetics of the mammalian phosphatidylinositol transfer protein phospholipid exchange cycle (2017) (19)
- Effects of Membrane PEGylation on Entry and Location of Antifungal Drug Itraconazole and Their Pharmacological Implications. (2017) (18)
- Long-chain GM1 gangliosides alter transmembrane domain registration through interdigitation. (2017) (18)
- Dynamics and scaling of polymers in a dilute solution: analytical treatment in two and higher dimensions. (2005) (17)
- Non-equilibrium effects in profile evolution measurements of surface diffusion (2000) (17)
- On Atomistic Models for Molecular Oxygen. (2017) (17)
- Dynamics of the Peripheral Membrane Protein P2 from Human Myelin Measured by Neutron Scattering—A Comparison between Wild-Type Protein and a Hinge Mutant (2015) (17)
- DNA overstretching transition: ionic strength effects. (2005) (17)
- Interaction of C70 fullerene with the Kv1.2 potassium channel. (2012) (17)
- Diffusion and mobility of interacting particles on stepped surfaces along the ledges (2004) (16)
- New tests of random numbers for simulations in physical systems (1994) (16)
- What Can We Learn about Cholesterol's Transmembrane Distribution Based on Cholesterol-Induced Changes in Membrane Dipole Potential? (2016) (16)
- Lipid bilayers driven to a wrong lane in molecular dynamics simulations by truncation of long-range electrostatic interactions (2003) (16)
- Reduced level of docosahexaenoic acid shifts GPCR neuroreceptors to less ordered membrane regions (2019) (16)
- A dynamical mean field theory for the study of surface diffusion constants (1997) (16)
- How Anacetrapib Inhibits the Activity of the Cholesteryl Ester Transfer Protein? Perspective through Atomistic Simulations (2014) (16)
- Can pyrene probes be used to measure lateral pressure profiles of lipid membranes? Perspective through atomistic simulations. (2014) (15)
- Pulmonary Surfactant Lipid Reorganization Induced by the Adsorption of the Oligomeric Surfactant Protein B Complex. (2020) (15)
- The F1 loop of the talin head domain acts as a gatekeeper in integrin activation and clustering (2020) (15)
- Effect of galactosylceramide on the dynamics of cholesterol-rich lipid membranes. (2011) (15)
- Atomistic determinants of co-enzyme Q reduction at the Qi-site of the cytochrome bc1 complex (2016) (15)
- Apolipoprotein A-I mimetic peptide 4F blocks sphingomyelinase-induced LDL aggregation[S] (2015) (15)
- Structure and dynamics of a human myelin protein P2 portal region mutant indicate opening of the β barrel in fatty acid binding proteins (2018) (15)
- Framework for testing random numbers in parallel calculations. (1999) (15)
- How To Minimize Artifacts in Atomistic Simulations of Membrane Proteins, Whose Crystal Structure Is Heavily Engineered: β₂-Adrenergic Receptor in the Spotlight. (2015) (14)
- Calcium Assists Dopamine Release by Preventing Aggregation on the Inner Leaflet of Presynaptic Vesicles. (2017) (14)
- Data including GROMACS input files for atomistic molecular dynamics simulations of mixed, asymmetric bilayers including molecular topologies, equilibrated structures, and force field for lipids compatible with OPLS-AA parameters (2016) (14)
- Membrane-Dependent Binding and Entry Mechanism of Dopamine into Its Receptor (2020) (14)
- Co-Exposure with Fullerene May Strengthen Health Effects of Organic Industrial Chemicals (2014) (14)
- Interplay between steps and nonequilibrium effects in surface diffusion for a lattice-gas model of OW(110). (2007) (14)
- Quantitative Assessment of Methods Used To Obtain Rate Constants from Molecular Dynamics Simulations-Translocation of Cholesterol across Lipid Bilayers. (2018) (14)
- High‐content imaging and structure‐based predictions reveal functional differences between Niemann‐Pick C1 variants (2019) (13)
- Crystalline Wax Esters Regulate the Evaporation Resistance of Tear Film Lipid Layers Associated with Dry Eye Syndrome (2019) (13)
- Drug-Lipid Membrane Interaction Mechanisms Revealed Through Molecular Simulations (2012) (13)
- Tail-Oxidized Cholesterol Enhances Membrane Permeability for Small Solutes (2020) (12)
- Negatively Charged Gangliosides Promote Membrane Association of Amphipathic Neurotransmitters (2018) (12)
- Cholesterol Protects the Oxidized Lipid Bilayer from Water Injury: An All-Atom Molecular Dynamics Study (2018) (12)
- Temperature-induced structural transition in-situ in porcine lens--changes observed in void size distribution. (2010) (12)
- Lipid membranes: Theory and simulations bridged to experiments. (2016) (12)
- SHANK3 conformation regulates direct actin binding and crosstalk with Rap1 signaling (2021) (12)
- Cryo-EM, X-ray diffraction, and atomistic simulations reveal determinants for the formation of a supramolecular myelin-like proteolipid lattice (2020) (11)
- Molecular mechanism for inhibition of twinfilin by phosphoinositides (2018) (11)
- Enhanced dielectrophoresis of nanocolloids by dimer formation (2007) (11)
- Insights into activation and RNA binding of trp RNA‐binding attenuation protein (TRAP) through all‐atom simulations (2008) (11)
- Non-equilibrium effects in profile spreading on stepped surfaces (2003) (11)
- Complexity of seemingly simple lipid nanodiscs. (2020) (11)
- Revealing structural and dynamical properties of high density lipoproteins through molecular simulations (2012) (10)
- Nonequilibrium effects in diffusion of interacting particles on vicinal surfaces. (2005) (10)
- Comment on “Surface diffusion near the points corresponding to continuous phase transitions” [J. Chem. Phys. 109, 3197 (1998)] (1999) (10)
- Dynamical mean field theory: an efficient method to study surface diffusion coefficients (1998) (10)
- Memory effects in Arrhenius barriers for surface diffusion (1998) (10)
- Nanoparticle-Membrane Interactions: The Role of Temperature and Lipid Charge on Intake/Uptake of Cationic Gold Nanoparticles into Lipid Bilayers (Small 23/2019) (2019) (10)
- The Devil Is in the Details: What Do We Really Track in Single-Particle Tracking Experiments of Diffusion in Biological Membranes? (2019) (10)
- Antidepressants act by binding to the cholesterol-interaction site at TRKB neurotrophin receptor (2019) (9)
- Vattulainen et al. Reply (1998) (9)
- How to link pyrene to its host lipid to minimize the extent of membrane perturbations and to optimize pyrene dimer formation. (2014) (9)
- Understanding the Functional Properties of Lipid Heterogeneity in Pulmonary Surfactant Monolayers at the Atomistic Level (2020) (9)
- Desipramine induces disorder in cholesterol-rich membranes: implications for viral trafficking (2009) (9)
- Velocity correlations and memory functions in surface diffusion (2000) (8)
- N-Glycosylation can selectively block or foster different receptor–ligand binding modes (2021) (8)
- The Na,K-ATPase acts upstream of phosphoinositide PI(4,5)P2 facilitating unconventional secretion of Fibroblast Growth Factor 2 (2020) (7)
- Nonexponential decay of velocity correlations in surface diffusion: The role of interactions and ordering (2000) (7)
- Effects of quenched impurities on surface diffusion, spreading, and ordering of O/W(110) (2002) (7)
- Oxidation of cholesterol does not alter significantly its uptake into high-density lipoprotein particles. (2015) (6)
- Collective Dynamics in Lipid Membranes: From Pore Formation to Flip-Flops (2009) (6)
- Density profile evolution and nonequilibrium effects in partial and full spreading measurements of surface diffusion (2001) (6)
- Surface diffusion of long chainlike molecules: The role of memory effects and stiffness on effective diffusion barriers (2000) (6)
- Cholesterol promotes both head group visibility and clustering of PI(4,5)P2 driving unconventional secretion of Fibroblast Growth Factor 2 (2021) (5)
- Machine learning in the analysis of biomolecular simulations (2022) (5)
- Modeling of Biologically Motivated Soft Matter Systems (2010) (5)
- Building Synthetic Sterols Computationally – Unlocking the Secrets of Evolution? (2015) (5)
- Atomistic Simulations of Functional Au 144 (SR) 60 Gold Nanoparticles in (2012) (5)
- The Na,K-ATPase acts upstream of phosphoinositide PI(4,5)P2 facilitating unconventional secretion of Fibroblast Growth Factor 2. (2020) (5)
- Comment on “Finite-size scaling behavior of the tracer surface diffusion coefficient near a second-order phase transition” by F. Nieto et al. (2000) (5)
- Oxidation of Cholesterol Changes the Permeability of Lipid Membranes (2017) (4)
- Seipin traps triacylglycerols to facilitate their nanoscale clustering in the ER membrane (2020) (4)
- Influence of Implementation on the Properties of Pseudorandom Number Generators with a Carry Bit (1993) (4)
- Diffusion and mobility of interacting particles on stepped surfaces (2003) (4)
- Atomistic determinants of coenzyme Q reduction at the Qi-site of the cytochrome bc 1 complex (2016) (4)
- Biogenesis of Nascent High Density Lipoprotein Particles. (2015) (4)
- How to measure velocity correlations from surface diffusion experiments by STM (2001) (3)
- Atomistic Molecular Dynamics Simulations of Mitochondrial DNA Polymerase γ: Novel Mechanisms of Function and Pathogenesis. (2017) (3)
- Long-Range Interactions in Molecular Simulations: Accuracy and Speed (2004) (3)
- Visualization of complex processes in lipid systems using computer simulations and molecular graphics. (2009) (3)
- Composition and lipid spatial distribution of High Density Lipoprotein particles in subjects with low and high HDL-cholesterol (2010) (3)
- How Well Does BODIPY-Cholesteryl Ester Mimic Unlabeled Cholesteryl Esters in High Density Lipoprotein Particles? (2015) (3)
- Publisher’s Note: Dynamics and scaling of two-dimensional polymers in a dilute solution [Phys. Rev. E68, 050102 (2003)] (2003) (2)
- Modeling of Lipid Membranes and Lipoproteins (2014) (2)
- Glycosylation Affects the Conformational Behavior of EGFR (2016) (2)
- Nanoparticle builder: new software for preparing nanoparticles for molecular dynamics simulations (2017) (2)
- Atomistic Molecular Dynamics Simulations of Mitochondrial DNA Polymerase gamma Euro , Liliya 2017-03-07 (2)
- Structure of spheroidal HDL particles revealed by combined atomistic and coarse-grained simulations (Biophysical Journal (2008) 94,6 (2306-2319)) (2008) (2)
- Structure and dynamics of a human myelin protein P 2 portal region mutant indicate opening of the β barrel in fatty acid binding proteins (2018) (2)
- Correction to "On Atomistic Models for Molecular Oxygen". (2020) (2)
- Conformational dynamics regulate SHANK3 actin and Rap1 binding (2020) (2)
- Non-equilibrium surface diffusion of the O/W(110) system (1996) (2)
- Author Correction: An efficient auxin-inducible degron system with low basal degradation in human cells (2019) (2)
- Dimerization of the pulmonary surfactant protein C in a membrane environment (2022) (2)
- Probing The Microstructure Of Biomaterials With Positrons (2009) (1)
- Oxidation of Cholesterol Changes the Physical Properties of Lipid Membranes (2016) (1)
- Exploring the effect of anaesthetic gases on biomembranes (2005) (1)
- Reply to the comment by Graziano on [The hydrophobic effect and its role in cold denaturation] (2010) (1)
- Antidepressants act by binding to the transmembrane domain of TRKB receptor (2019) (1)
- Maturation of the SARS-CoV-2 virus is regulated by dimerization of its main protease (2022) (1)
- Effect of replacement of cholesterol hydroxyl group by ketone group (2007) (1)
- Topology and structure of Au144(SRCOO-)60 from "Atomistic Simulations of Functional Au144(SR)60 Gold Nanoparticles in Aqueous Environment" (2012) (1)
- Coarse-Grained Simulations Of Lipid Membranes With Various Concentrations Of Embedded Proteins (2017) (1)
- Author response: Mechanism of allosteric regulation of β2-adrenergic receptor by cholesterol (2016) (1)
- Determinants for forming a supramolecular myelin-like proteolipid lattice (2020) (1)
- Studies of Surface Diffusion Under Non-Equilibrium Conditions (1997) (1)
- Dissecting the mechanisms of environment sensitivity of smart probes for quantitative assessment of membrane properties. (2023) (1)
- PI(4,5)P2 Binds to Phospholipase C Delta 1 in a Cholesterol Concentration Dependent Manner: Perspective on Implications to PI(4,5)P2-Binding Proteins (2017) (1)
- Flip-Flops of Lipids in the Absence of Atp: Role of Membrane Proteins (2014) (1)
- Cholesterol promotes clustering of PI(4,5)P2 driving unconventional secretion of FGF2 (2022) (1)
- Differences between lateral pressure profiles of one-component and many-component lipid membranes (2007) (1)
- Reply to the comment by Uebing and Zhdanov (1998) (1)
- Publisher Correction: Molecular mechanisms of Charcot-Marie-Tooth neuropathy linked to mutations in human myelin protein P2 (2018) (1)
- Molecular dynamics simulations of neutral lipids found in lipoproteins (2007) (1)
- Structure of tear film lipid layer models containing cholesteryl esters and lysophosphatidylcholine (2018) (1)
- Molecules Dancing in Membranes (2005) (1)
- Avalanches, hardening and softening in dense cross-linked actin networks (2008) (1)
- Development of a Syrian hamster anti-PD-L1 monoclonal antibody enables oncolytic adenoviral immunotherapy modelling in an immunocompetent virus replication permissive setting (2023) (1)
- Systematic Approach to Coarse-Graining of Molecular Descriptions and Interactions with Applications to Lipid Membranes (2008) (1)
- The Integrin Receptor in Biologically Relevant Bilayers: Insights from Molecular Dynamics Simulations (2016) (1)
- SELF-ORGANIZING MAPS IN CONFORMATIONAL ANALYSIS OF LIPIDS (0)
- Characterization of the effects of ethanol and methanol on lipid bilayers (2005) (0)
- Specific Spatial and Orientational Order in Phospholipid Membranes Induced by Cholesterol (2010) (0)
- NaCl and Cationic lipid bilayer dynamics (2009) (0)
- IMULATION S TUDIES FOR C OLLECTIVE A DATOM D IFFUSION S TEPPED S URFACES (2004) (0)
- Protocol to Avoid Possible Artifacts in Atomistic Simulation of GPCR Proteins whose Crystal Structure is Heavily Engineered (2016) (0)
- Simulations Of Gpa-Based Dimers Of Various Lengths In Depc, Dopc, And Dlpc Bilayers, Part 1/2 (2017) (0)
- Targeting a broad spectrum of KRAS-mutant cancers by hyperactivation-induced cell death (2022) (0)
- Glucosylceramide modifies the LPS-induced inflammatory response in macrophages and the orientation of the LPS/TLR4 complex in silico (2018) (0)
- Substrate Binding at the Qo-Site of the Bacterial Cytochrome bc1 Complex Predicted by Atomistic Molecular Dynamics Simulations (2013) (0)
- Binding of Hyaluronic Acid to Its CD 44 Receptor (2014) (0)
- Molecular dynamics modeling of polymer fragment dielectrophoresis (2005) (0)
- Model Studies of Collective Diffusion (2001) (0)
- SoftSimu2002 - Novel Methods in Soft Matter Simulations (2002) (0)
- Atomistic simulations of cationic lipid membranes: effect of salt (2005) (0)
- Molecular dynamics studies of spontaneous pore formation and ion transport through lipid membranes due to cationic electrochemical gradient (2006) (0)
- Interaction of Fullerene with Model Cell Membranes: a Computer Simulation Study (2009) (0)
- Oxysterol Translocation through Lipid Bilayers (2018) (0)
- What Happens for Sterol Dynamics When Cholesterol is Enzymatically Oxidized (2014) (0)
- Dynamics, kinetics and partitioning of alcohols in lipid membranes (2006) (0)
- Author response for "Cholesterol recognition motifs in the transmembrane domain of the tyrosine kinase receptor family: the case of TRKB" (2021) (0)
- Non-equilibrium effects in spreading and diffusion on stepped surfaces. (2004) (0)
- Molecular Basis of GLUT4 in Glucose Transport: Atomistic Molecular Dynamics Study (2017) (0)
- Memory Effects and Memory Functions in Surface Diffusion (2001) (0)
- THE ROLE OF GLYCOLIPIDS IN LIPID RAFTS: MOLECULAR DYNAMICS SIMULATIONS OF MEMBRANES WITH GALACTOSYLCERAMIDE (2007) (0)
- Characterisation of Coexisting Liquid Phases in Mixtures of Dipalmitoylphosphatidylcholine and Cholesterol (2014) (0)
- Lateral Pressure Profile and Curvature Frustration in Mechanosensitive Channel Gating (2010) (0)
- A Comparison Of Ceramide And Ceramide-1-phosphate Miscibility In Phosphatidylcholine Bilayers (2009) (0)
- SCRAMBLASE PROPERTIES OF RHODOPSIN STUDIED WITH BIASED MOLECULAR DYNAMICS SIMULATIONS (2011) (0)
- Computational investigation of the redox-coupled proton pumping in respiratory complex I (2016) (0)
- Surfactant Proteins SP-B and SP-C in Pulmonary Surfactant Monolayers: Physical Properties Controlled by Specific Protein–Lipid Interactions (2022) (0)
- ANTTI LAMBERG CURVATURE EFFECTS IN LIPOPROTEIN FUSION (2011) (0)
- The Interactions of Dopamine and L-Dopa with Lipid Headgroup and its Implication for Neurotransmitters Metabolism (2013) (0)
- Lateral pressure profiles of lipid membranes - Dependence on lipid composition (2007) (0)
- Computer simulation studies for collective adatom stepped surfaces (2007) (0)
- Molecular dynamics simulation of glycolipids bilayer (2005) (0)
- Dynamics and Lateral Pressure Profiles of Lipid Rafts (2008) (0)
- How Different Ctxs Bind to a Lipid Nanobio Membrane? (2013) (0)
- The Effect of Membrane Polyunsaturated Fatty Acids on Receptor Partitioning to Ordered Domains (2017) (0)
- The Effect of Membrane Polyunsaturated Fatty Acids on Receptor Partitioning to Ordered Domains (2017) (0)
- How the Properties of Nanodiscs Are Modulated by their Size and Lipid Content (2018) (0)
- N-glycosylation blocks and simultaneously fosters different receptor-ligand binding sites: the chameleonic CD44–hyaluronan interaction (2020) (0)
- Cholesterol Protects the Oxidized Lipid Bilayer from Water Injury: An All-Atom Molecular Dynamics Study (2018) (0)
- Conference Report on "SoftSimu2002 - Novel Methods in Soft Matter Simulations" (2002) (0)
- University of Southern Denmark Atomistic fingerprint of hyaluronan-CD44 binding Vuorio, (2017) (0)
- New Paradigms for the Mechanisms of Thrombopoietin Receptor Activation and Dysregulation By the JAK2V617F Mutation (2019) (0)
- 31G3D03 - Glycosylation as a means to modulate membrane receptor conformation and visibility (2021) (0)
- Bridging a Gap Between Cytochrome Bc1 Complex Structure and Function (2014) (0)
- Molecular dynamics study of β-sheet in a lipoprotein-like lipid particle containing cholesteryl esters and POPCs (2007) (0)
- How does membrane composition modulate cholesterol carrier protein NPC2 (2017) (0)
- Revealing the Microstructural Changes in Tissues In-Situ with Positron Annihilation Spectroscopy (2010) (0)
- Barriers in the Eye and Lungs that Maintain Biological Functions (2021) (0)
- 21aXJ-7 Had a drink last night? Molecular dynamics simulations of the effect of alcohols on biomembranes (2005) (0)
- Disulfide bridge-dependent dimerization triggers FGF2 membrane translocation into the extracellular space (2023) (0)
- Presence of oxysterols affects permeability of lipid bilayers (2017) (0)
- Hidden Errors in Simulations and the Quality of Pseudorandom Numbers (1993) (0)
- THE STRUCTURE OF HUMAN TEAR FLUID AT THE AIR-WATER INTERFACE - A COMPUTATIONAL STUDY (2007) (0)
- Syddansk Universitet Apolipoprotein A-I mimetic peptide 4 F blocks sphingomyelinase-induced LDL aggregation (2015) (0)
- Multiscale simulations of domain formation in single-component phospholipid bilayers (2007) (0)
- ENERGETICS OF PHOSPHOLIPID TRANSLOCATION MEDIATED BY β 2-ADRENERGIC RECEPTOR (2014) (0)
- Structural basis of actin monomer re-charging by cyclase-associated protein (2018) (0)
- The Role of Hydrophobic Mismatch on Transmembrane Helix Dimerization in Living Cells (2019) (0)
- Author response: Key steps in unconventional secretion of fibroblast growth factor 2 reconstituted with purified components (2017) (0)
- Diffusion driving the formation of functional nanoscale machines in cell membranes (2015) (0)
- Specific interactions between cholesterol, sphingomyelin and POPC (2006) (0)
- Multi-scale modeling environment for nanocellulose applications (2010) (0)
- Computational Studies of the Integrin Receptor in Complex Biologically Relevant Lipid Bilayers (2013) (0)
- Molecules D ancing in M embranes (2005) (0)
- Molecular dynamics modeling of nanoparticle dielectrophoresis (2006) (0)
- Interaction of Hematoporphyrin with Lipid Membranes B (2012) (0)
- Cholesterol esters form supercooled lipid droplets whose nucleation is facilitated by triacylglycerols (2023) (0)
- Towards more systematic selection of coarse-grained degrees of freedom (2007) (0)
- MECHANISMS OF RHODOPSIN-MEDIATED LIPID FLIP-FLOP (2011) (0)
- Site-directed mutagenesis studies of h 15-LOX-1 and their effects on inhibitor potency (2015) (0)
- Publisher Correction: Molecular mechanisms of Charcot-Marie-Tooth neuropathy linked to mutations in human myelin protein P2 (2018) (0)
- Atomistic Simulations of Functional Gold Nanoparticles Au144(Sr)60 Interacting with Membranes (2013) (0)
- Cell Membrane Composition Affects GPCR Aggregation (2014) (0)
- Random-Lattice Simulations of Biomembranes (2004) (0)
- Marja Hyvönen 1970-2016 (2016) (0)
- DEFINING THE ROLE OF SYNAPTIC MEMBRANE FOR NEUROTRANS- MITTER ENTRY INTO ADENOSINE 2A RECEPTOR (2013) (0)
- Cholesterol-dependent effect of antidepressants on activation BDNF receptor (TRKB) (2019) (0)
- The α1 subunit of the Na,K-ATPase acts upstream of PI(4,5)P2 facilitating unconventional secretion of Fibroblast Growth Factor 2 from tumor cells (2019) (0)
- Regulation of cell dynamics by rapid transport of integrins through the biosynthetic pathway (2022) (0)
- Ionic Cloud Distribution Close a Charged Surface and Overcharging (2008) (0)
- SAMI RISSANEN BINDING OF CHOLERA TOXIN TO LIPID BILAYERS OF VARIOUS (2013) (0)
- Title : Tracer diffusion in colloidal suspensions under dilute and crowded conditions with hydrodynamic interactions Year : 2012 Version : Final (2015) (0)
- Syddansk Universitet The Integrin Receptor in Biologically Relevant Bilayers Insights from Molecular Dynamics Simulations (2016) (0)
- Preliminary models of spheroidal HDL particles through molecular dynamics (2007) (0)
- Effect of farnesol on phospholipid membranes (2007) (0)
- Phosphorylation Alters the Transmembrane Binding Interface Between Phospholamban and SERCA (2014) (0)
- Molecular nature of the conformational and electrostatic coupling in the proton pumping mechanism of complex I (2014) (0)
- Clarifying the Roles of Cardiolipin (2014) (0)
- Protein Crowding and Cholesterol Increase Cell Membrane Viscosity in a Temperature Dependent Manner (2023) (0)
- The Key Role of Temperature and Lipid Composition in Modulating the Intake of Gold Nanoparticles into the Plasma Membrane (2019) (0)
- Cholesterol Modulated Interdigitation of Long-Chain Sphingomyelin and Glycolipids (2016) (0)
- From Discoidal to Spheroidal HDL particles through All Atom and Coarse Grained Molecular Dynamics simulations (2008) (0)
- Molecular mechanisms of Charcot-Marie-Tooth neuropathy linked to mutations in human myelin protein P2 (2017) (0)
- Systematic coarse-graining on multicomponent lipid bilayers (2006) (0)
- Dissecting the mechanisms of environment sensitivity of smart probes for quantitative assessment of membrane properties (2022) (0)
- Initial Steps in the PI(4,5)P 2 dependent Fibroblast Growth Factor 2 Oligomerization (2018) (0)
- human insulin receptor ectodomain bound by 4 insulin (2019) (0)
- Distribution of Ion Clouds with Respect to a Charged Surface in the Presence of Salt (2008) (0)
- Had a drink last night? How alcohol interacts with biological membranes (2006) (0)
- Lipids: Organization and Aggregation (2008) (0)
- Author ' s personal copy The hydrophobic effect and its role in cold denaturation q (2010) (0)
- A cholesterol analog stabilizes the human β2-adrenergic receptor nonlinearly with temperature (2022) (0)
- DOPC lipid bilayer with PYR10 simulation trajectory and files from Franova et al. BBA 1838 (2014) 1406–1411 (2015) (0)
- Atomistic fingerprint of hyaluronan – CD 44 binding Citation (2017) (0)
- From Discoidal to Spheroidal HDL particles through Coarse Grained and All Atom Molecular Dynamics Simulations (2008) (0)
- Diffusion of Proteins and Lipids in Protein-Rich Membranes (2018) (0)
- Itraconazole Perturbs Behavior of Fluorescent Probes in Lipid Bilayer (2019) (0)
- Simulations Of Gpa-Based Dimers Of Various Lengths In Depc, Dopc, And Dlpc Bilayers, Part 2/2 (2017) (0)
- Nanoscale Membrane Domain Formation Driven by Cholesterol Citation (2017) (0)
- Cholesterol methyl groups—molecular fossils? (2007) (0)
- Diffusion mechanisms of lipids in bilayers (2006) (0)
- A critical role for cholesterol in PI(4,5)P2-dependent unconventional secretion of fibroblast growth factor 2 (2022) (0)
- Direct Visualization and Quantification of Doc2B-Mediated Membrane Fusion (2014) (0)
- STRUCTURE AND MEDIUM EFFECTS - A COMPUTATIONAL STUDY ON THE PHOTOPHYSICS OF CIPROFLOXACINE (2007) (0)
- Membrane properties and sterol interactions of sphingomyelin head group analogs (2010) (0)
- Influence of free pyrene probes on gel and fluid membranes through atomistic simulations (2007) (0)
- Vitamin E acetate alters properties of pulmonary surfactant (2022) (0)
- Structure Previews BiogenesisofNascentHighDensityLipoproteinParticles (2015) (0)
- SOFT MATTER PHYSICS AND BIOMEMBRANES (2013) (0)
- Lipids, Neurotransmitters and their Receptors (2017) (0)
- Nanoscale Membrane Domain Formation Driven by Cholesterol (2017) (0)
- How to Ecien tly Deal with Electrostatic Interactions in Soft Matter Simulations: The Reaction-Field Approach (2004) (0)
- Water matters : role of water in the binding selectivity of β-blockers to human β-adrenergic receptors (2013) (0)
- Transport and effects of chlorpromazine on POPC and POPS lipid bilayers (2007) (0)
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