Concepedia

New insights into the capture performance and mechanism of hazardous metals Cr3+ and Cd2+ onto an effective layered double hydroxide based material

Sidi Zhu, Muhammad Asim Khan, Tomohito Kameda, Haihua Xu, Fengyun Wang, Mingzhu Xia, Toshiaki Yoshioka

Journal of Hazardous Materials · 2021 · 238 citations · 80 references

DOI

Concepts

References

80

VMD: Visual molecular dynamics

William Humphrey, Andrew Dalke, Klaus Schulten · Journal of Molecular Graphics · 1996 · 66.6K citations

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Multiwfn: A multifunctional wavefunction analyzer

Tian Lu, Feiwu Chen · Journal of Computational Chemistry · 2011 · 43K citations

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Atoms in Molecules — a Quantum Theory

W.J. Orville-Thomas · Journal of Molecular Structure THEOCHEM · 1996 · 2.9K citations

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Structure and energetics of ligand binding to proteins: <i>Escherichia coli</i> dihydrofolate reductase‐trimethoprim, a drug‐receptor system

Pnina Dauber‐Osguthorpe, Victoria A. Roberts, David J. Osguthorpe et al. · Proteins Structure Function and Bioinformatics · 1988 · 2.1K citations

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Chemical Bonds without Bonding Electron Density — Does the Difference Electron‐Density Analysis Suffice for a Description of the Chemical Bond?

Dieter Cremer, Elfi Kraka · Angewandte Chemie International Edition in English · 1984 · 1.6K citations

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