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Claudio Bantaloukas edited this page
Dec 8, 2021
·
8 revisions
Frequently Asked Questions
DASH Manual Pages
Introduction
General Features of the Windows Interface
Data Collection and Data Treatment
Preliminary Inspection of Profile
General Hints on Selecting, Fitting and Measuring Peaks
Indexing
Space Group Determination
Pawley Fitting
Building and Constraining Molecules
Structure Solution
Running DASH in Grid Mode or Batch Mode
Rigid-body Rietveld refinement
Preparation of Single Crystal Data
Appendixes
Programs for Indexing and Cell Reduction
Programs for Building 3D Molecules
Definitions of DASH Figures of Merit
Frequency of Occurrence of Space Groups
Extinction Symbols and their Space Groups
Using the Cambridge Structural Database
Z-matrix format
References
Tutorials
Tutorial 1: Step-by-Step Structure Solution of Hydrochlorothiazide
Tutorial 2: Solving a Structure from a Low Resolution Data Set
Tutorial 3: Handling
cis/trans
Isomerism
Tutorial 4: Handling a Structure in Which There is a Space Group Ambiguity
Tutorial 5: Dealing with Two Molecules in the Asymmetric Unit
Tutorial 6: Solving the Structure of an Inorganic Compound
Developing DASH
Provisioning a build machine
Building DASH
Smoke Tests
Wiki pages
Pages
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DASH Manual Pages
Appendixes
Tutorials
Developing DASH
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Building DASH
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BuildingAndConstrainingMolecules
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DataCollectionAndTreatment
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ExtinctionSymbolsAndSpaceGroups
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FiguresOfMerit
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FrequencyOfOccurenceOfSpaceGroups
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Frequently Asked Questions
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HintsOnPeaks
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Indexing
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InterfaceFeatures
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Introduction
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PawleyFitting
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PreliminaryProfileInspection
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PreparationOfSingleCrystalData
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ProgramsForBuilding3dMolecules
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ProgramsForIndexingAndCellReduction
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Provisioning a build machine
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References
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RietveldRefinement
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RunningInGridOrBatchMode
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Smoke tests
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SpaceGroupDetermination
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StructureSolution
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Tutorial01
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UsingTheCSD
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