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Application

Discovery Studio 1.0 Materials Studio 0.9267945984363894 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06544502617801047 Amorphous Cell 0.24607329842931938 Blends 0.004188481675392671 CASTEP 0.4612565445026178 CDOCKER 0.16806282722513088 CHARMm 0.27015706806282724 COMPASS 0.38900523560209427 COMPASS III 0.024607329842931937 COSMObase 5.235602094240838E-4 COSMOconf 0.0010471204188481676 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 0.0 COSMOquick 0.002617801047120419 COSMOtherm 0.06230366492146597 Catalyst 0.19109947643979058 Classical Simulations 0.9790575916230366 Conformers 0.0020942408376963353 Crystallization 0.08010471204188482 DFTB Plus 0.005235602094240838 DMol3 0.24083769633507854 DPD 0.005759162303664921 Discover 0.007329842931937173 Forcite 0.49476439790575916 GULP 0.041884816753926704 LUDI 0.008376963350785341 LibDock 0.06649214659685863 LigandFit 0.0062827225130890054 MCSS 5.235602094240838E-4 MODELER 0.07696335078534032 MesoDyn 0.0010471204188481676 Mesocite 0.007853403141361256 Mesoscale 0.013089005235602094 Morphology 0.01780104712041885 ONETEP 0.0020942408376963353 Polymorph 0.0010471204188481676 QMERA 0.0 QSAR 0.0020942408376963353 Quantum Mechanics 0.6853403141361256 Reflex 0.060209424083769635 Reflex Plus 0.0010471204188481676 Reflex QPA 0.0 Semi-empirical 0.008900523560209424 Sorption 0.04607329842931937 Synthia 0.0 TURBOMOLE 0.0010471204188481676 VAMP 0.002617801047120419 Visualization 1.0 X-Cell 0.0015706806282722514 ZDOCK 0.02617801047120419

Year

2023 0.0

Keywords

target 1.0 visualization 0.23470839260312945 docking 0.22373501320869743 potential 0.20382036171509857 analysis 0.13879292826661246 between 0.13615118878276772 novel 0.0790489737858159 energy 0.07132696606380817 binding 0.05710221499695184 activity 0.05689900426742532 interaction 0.045925624872993294 cell 0.03840682788051209 protein 0.03007518796992481 synthesized 0.029262345051818735 experimental 0.027839869945133103 mechanism 0.01767933346880715 chemical 0.01219264377159114 compound 0.011379800853485065 synthesis 0.009550904287746393 well 0.005486689697216013 stability 0.003251371672424304 development 0.001219264377159114 promising 6.09632188579557E-4 drug 4.06421459053038E-4 silico 0.0
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