Examples of 'computational chemistry' in a sentence
Meaning of "computational chemistry"
computational chemistry ~ The use of computer simulations and modeling to study chemical systems and processes
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- The use of computation to predict the structure, properties and reactions of molecules
How to use "computational chemistry" in a sentence
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computational chemistry
I saw the computational chemistry system running.
After retirement he keeps working in computational chemistry.
One aspect of computational chemistry is molecular modeling.
He may be regarded as the initiator of modern computational chemistry.
Computational chemistry supports these assignments.
Graphical user interface to computational chemistry packages.
I sat computational chemistry with you four months ago.
Graphical display of computational chemistry output.
Computational chemistry plays a central role in modern chemical research.
Basis sets used in computational chemistry.
Computational chemistry software.
Another way is to use computational chemistry.
Computational chemistry and.
About theoretical and computational chemistry.
Computational chemistry was used to provide the electronic properties of these new compounds.
See also
computational approaches
computational biology
computational complexity
computational complexity theory
computational biology
computational complexity
computational complexity theory
Molecular visualizer for computational chemistry.
Various teams used computational chemistry in order to suggest a conformational model for the protein.
A diversity of techniques have been proposed for computational chemistry.
They can not wait to do computational chemistry at a quadrillion calculations per second.
He is an active research scientist in quantum chemistry and computational chemistry.
Introduction to computational chemistry.
An alternate meaning for the term electron hole is used in computational chemistry.
Ab initio quantum chemistry methods are computational chemistry methods based on quantum chemistry.
Advances in modeling software have made possible the development of digital or computational chemistry.
The compounds should allow computational chemistry to predict additional active materials.
Others have only been predicted using computational chemistry.
The file format is used in computational chemistry programs for importing and exporting geometries.
The list also hosts many resources on computational chemistry.
Also in other fields has computational chemistry become the leading tool to find new discoveries.
These assignments are gaining increased support with computational chemistry.
Almost all basis sets used in computational chemistry now employ these orbitals.
Mechanosynthesis is largely based upon the confluence of atomic microscopy and computational chemistry.
Doctoral Candidate to computational chemistry research group.
The methods used in molecular modeling range from molecular graphics to computational chemistry.
Her history of computational chemistry in Germany is of particular note.
Molecular modeling is employed in the field of computational chemistry for decades.
Nanotechnology and computational chemistry win the first edition of Falling Walls Lab Barcelona.
Specialized journals on computational chemistry.
Computational chemistry has two different aspects,.
The list is widely supported and used by the computational chemistry community.
Molecular design, computational chemistry and chemoinformatics applied to drug design.
Work continues on the use of stem cells and computational chemistry and systems biology.
Using computational chemistry to discover, enhance, or study drugs and related biologically active molecules.
Sastry has made pioneering contributions in the areas of computational chemistry and computational biology.
Category, Computational chemistry software.
Nobel Prize in Chemistry awarded for foundations of computational chemistry.
IBM has invested heavily in new computational chemistry technologies that rely on supercomputers.
We worked in the theoretical department, in the field of computational chemistry.
Many self-sufficient computational chemistry software packages exist.
Studying these cations was sparked, at the time, by amazing results in computational chemistry.
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Examples of using Computational
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I saw the computational chemistry system running
The procedure uses an iterative computational algorithm
Computational simulation of processes of interest in the area
