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Orbital visualisation. Standard ab initio quantum chemistry methods yield delocalised orbitals that extend over the entire molecule. Localised orbitals can be found as linear combinations of the occupied delocalised orbitals by a unitary transformation. In Molden the Foster-Boys [29] scheme is employed to localize molecular orbitals. The left-hand panel shows the localised orbital of Iron(III) meso tartaric acid. This calculation proves that there is a bond between the irons and the coordinated water molecules (ultimate left and right in the figure). The absence of nodal planes between iron (yellow) and water(s) is tantamount to the presence of electron density (a bond) between irons and water. The right-hand panel shows an example of the ELF on 2,5 Dimethoxyfuran with evidence of lone pairs and covalent bonds. Inset a ball-and-stick representation of the molecule (carbon in brown, oxygen in red, hydrogen in white)
Alignment of molecules -also known as structure superposition- has been implemented following two separate strategies, one for small molecule alignment and one for the alignment of proteins. The alignment of small molecules is illustrated in Fig. 4.
The Optimize button, located below the chosen Support Pokémon when a stage has been selected on the overworld, is designed to speed up the process of choosing Support Pokémon. Clicking on it will automatically choose four Support Pokémon based on several criteria. A random Pokémon that can Mega Evolve and has the greatest type advantage (i.e. super effective, then normal effectiveness if there are no super effective Pokémon capable of Mega Evolution, and so on) against the selected stage's Pokémon opponent will be chosen for the leftmost slot. The remaining slots will be filled by the Support Pokémon that currently have highest base damage (taking current Attack power and type effectiveness into account, but no other factors). If multiple Pokémon have the same base damage, they will be chosen randomly from within that group. If the player has no Pokémon that are able to Mega Evolve, all four slots will be filled in this way instead.
Dixon, Parker and Easton are the most common brands and they normally tend to work together. Most groups will have male fittings on all their equipment and tanks and use hoses with double female ends to manage cost. This is our preferred and the most common way we see most groups set up on the glycol side. The quick disconnect fittings are nice as they trap the glycol in the unit, the hose, and the tanks, making it super easy to clean and disconnect things.
Other groups will use male on the feed side and female on the returns, there is no wrong way to do this. It will come down to preference and budget. Some groups request camlock fitting and ball valves. And we have seen systems set up with now release fittings.
Zoom quality is a strong point of the device, thanks to a combination of three camera modules with super-resolution and fusion algorithms. The result is good detail preservation from ultra-wide to long-range tele. Overall, the Mate 50 Pro ranks second for Zoom, just behind the Honor Magic4 Ultimate, which offers slightly better detail at medium-range tele.
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The Lifetime and Include Country in Popup controls have been relocated from the Config window's General tab to the PlotSettings tab's DX Spots panel. 2.2.6 149 If the DXCC Award objectives specified in DXKeeper indicate that a mode is sought, but there are no confirmed QSOs with the selected DXCC entity in that mode, then the background of that mode's cells will be white rather than the window's background color.. Similarly, if the DXCC Award objectives specified in DXKeeper indicate that a band is sought, but there are no confirmed QSOs with the selected DXCC entity on that band, then the background of that band's cells will be white rather thant the window's background color. 2.2.9 150 display IOTA status and notes 2.3.1 152 when an IOTA tag is selected and DXKeeper is running, display the DXCC progress for the IOTA tag's DXCC entity 2.3.7 153 support Google Maps 2.3.8 154 ability to ignore DXView updates from SpotCollector by locking its display 2.3.9 155 ability to query QRZ.com via Pathfinder to update DXCC entity, CQ zone, ITU zone, and time zone 2.3.9 156 ability to highlight stations known to QSL via LotW 2.3.9 157 ability to control the colors used to highlight stations known to QSL via LotW 2.4.0 158 provide a panel on the Config window's General tab that displays the versions of the DXCC, IOTA, and LotW databases 2.4.0 159 record "connected DXLab applications" information in the errorlog.txt file 2.4.1 160 provide a Maidenhead Field overlay for the world map 2.4.5 161 provide the ability to specify the bands on which rotator control directives from other applications are accepted 2.4.6 162 display the most recent rotator heading and path, and make this information accessible to other applications 2.4.6 163 display logged QSOs on the build-in world map   indicate whether the all logged QSOs are plotted, or just those matching a specified filter  provide the option of showing only logged QSOs that are unworked, unconfirmed, confirmed, or verified  if the mouse cursor hovers near the plot of a logged QSO on the world map, display the QSO's callsign, DXCC entity, frequency, mode, and grid square   2.4.6 164 displays logged QSOs and logged DXCC entities on the DX Atlas world map 2.4.8 165 add a PKT option to the "RTTY mode if WinWarbler not running" panel 2.4.8 166 provide the option to display maidenhead field and grid square status on the DX Atlas world map 2.5.0 167 save and restore DX Atlas settings from the DXAtlas.ini file so that settings changes made when operating DX Atlas standalone are applied when running DX Atlas via DXView, and vice versa 2.5.0 168 provide the option to display information on the DX Atlas map, or only display plots and have the information appear when the mouse cursor hovers near a plot 2.5.0 169 clicking on the DX Atlas world map while not in pan mode should select the designated location, updating the Main window's latitude, longitude, distance, grid, and heading textboxes 2.5.0 170 clicking on a DX spot on the DX Atlas world map while depressing the Shift key QSY's the transceiver to the spot frequency (if Commander is running), initializes the QSO in DXKeeper's Capture window (if DXKeeper is running), and performs a Pathfinder lookup (if Pathfinder is running)  if the Ctrl key is depressed instead of the Shift key, the antenna is also rotated to the spotted station's shortpath heading if the Alt key is depressed instead of the Shift key, the antenna is als

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