The art of molecular graphics. It's a matter of scale

Modification of supported lipid membranes by atomic force microscopy.

Biophysical journal·2009

In-vitro release characteristics of tetracycline HCl, khellin and nicotinamide adenine dineculeotide from halloysite; a cylindrical mineral.

Journal of microencapsulation·2001

Diffusion and transfer of antibody proteins from a sugar-based hydrogel.

Applied biochemistry and biotechnology·1997

Expression of the Neurospora crassa metallothionein gene in Escherichia coli and its effect on heavy-metal uptake.

Applied microbiology and biotechnology·1995

Interaction of small peptides with lipid bilayers.

Biophysical journal·1995

Thermodynamics of interaction of the fusion-inhibiting peptide Z-D-Phe-L-Phe-Gly with dioleoylphosphatidylcholine vesicles: direct calorimetric determination.

Biochemistry·1995

Accelerating HDAC8 inhibitor discovery through deep learning, cheminformatics, docking, and molecular dynamics simulations.

Journal of molecular graphics & modelling·2026

Systematic benchmarking of AlphaFold and SWISS-MODEL kinase structures for structure-based drug discovery.

Journal of molecular graphics & modelling·2026

Stability-driven analysis of rhodium and ruthenium doping in titanium clusters: DFT study.

Journal of molecular graphics & modelling·2026

A geometry-guided computational framework for predicting functional immobilization orientations of plant peroxidases on chemically modified surfaces.

Journal of molecular graphics & modelling·2026

BLOSSOM-Kcr: A structure-informed deep learning framework for lysine crotonylation site prediction.

Journal of molecular graphics & modelling·2026

Integrative docking and molecular dynamics identify potential allosteric modulators of AKT1.

Journal of molecular graphics & modelling·2026

Integrative In Silico Profiling of Major Phytochemicals From a Sclerocarya birrea-Nauclea latifolia-Piper longum Mixture: Docking, Molecular Dynamics, ADMET, and Ligand-Based Target Prediction on Shared Pathways in Type 2 Diabetes Mellitus and Alzheimer's Disease.

ChemistryOpen·2026

Development of isonicotinoyl-azole hybrids as potential InhA inhibitors for anti-tubercular activity.

RSC medicinal chemistry·2026

A‑iMPO: A Design-Time Prediction Toolbox for Blood Brain Barrier Permeation Using an Integrated and Interpretable Multiparameter Optimization Framework.

ACS medicinal chemistry letters·2026

Multiscale Explainable Machine Learning Reveals Descriptor-Invariant Molecular Determinants of Small-Molecule PD-1/PD-L1 Inhibition.

ACS medicinal chemistry letters·2026

Discovery of High-Affinity Peptide Ligands Targeting the SPIN1 Tudor 3 Domain Via a Minimalist Pruning Strategy.

ACS medicinal chemistry letters·2026

An interpretable framework applying protein words to predict protein-small molecule complementary pairing rules.

Chemical science·2026

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The art of molecular graphics. It's a matter of scale

Related Concept Videos

Modification of supported lipid membranes by atomic force microscopy.

In-vitro release characteristics of tetracycline HCl, khellin and nicotinamide adenine dineculeotide from halloysite; a cylindrical mineral.

Diffusion and transfer of antibody proteins from a sugar-based hydrogel.

Expression of the Neurospora crassa metallothionein gene in Escherichia coli and its effect on heavy-metal uptake.

Interaction of small peptides with lipid bilayers.

Thermodynamics of interaction of the fusion-inhibiting peptide Z-D-Phe-L-Phe-Gly with dioleoylphosphatidylcholine vesicles: direct calorimetric determination.

Accelerating HDAC8 inhibitor discovery through deep learning, cheminformatics, docking, and molecular dynamics simulations.

Systematic benchmarking of AlphaFold and SWISS-MODEL kinase structures for structure-based drug discovery.

Stability-driven analysis of rhodium and ruthenium doping in titanium clusters: DFT study.

A geometry-guided computational framework for predicting functional immobilization orientations of plant peroxidases on chemically modified surfaces.

BLOSSOM-Kcr: A structure-informed deep learning framework for lysine crotonylation site prediction.

Integrative docking and molecular dynamics identify potential allosteric modulators of AKT1.

Integrative In Silico Profiling of Major Phytochemicals From a Sclerocarya birrea-Nauclea latifolia-Piper longum Mixture: Docking, Molecular Dynamics, ADMET, and Ligand-Based Target Prediction on Shared Pathways in Type 2 Diabetes Mellitus and Alzheimer's Disease.

Development of isonicotinoyl-azole hybrids as potential InhA inhibitors for anti-tubercular activity.

A‑iMPO: A Design-Time Prediction Toolbox for Blood Brain Barrier Permeation Using an Integrated and Interpretable Multiparameter Optimization Framework.

Multiscale Explainable Machine Learning Reveals Descriptor-Invariant Molecular Determinants of Small-Molecule PD-1/PD-L1 Inhibition.

Discovery of High-Affinity Peptide Ligands Targeting the SPIN1 Tudor 3 Domain Via a Minimalist Pruning Strategy.

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