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Application

Discovery Studio 1.0 Materials Studio 0.8494949494949495 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06173469387755102 Amorphous Cell 0.18112244897959184 Blends 0.00510204081632653 CASTEP 0.47244897959183674 CDOCKER 0.2096938775510204 CHARMm 0.24846938775510205 COMPASS 0.3525510204081633 COMPASS III 0.0035714285714285713 COSMOconf 0.0 COSMOmic 0.0 COSMOperm 0.0010204081632653062 COSMOplex 0.0 COSMOquick 0.001530612244897959 COSMOtherm 0.06428571428571428 Catalyst 0.07244897959183673 Classical Simulations 0.8744897959183674 Conformers 5.102040816326531E-4 Crystallization 0.06887755102040816 DFTB Plus 0.004081632653061225 DMol3 0.21428571428571427 DPD 0.007653061224489796 Discover 0.012755102040816327 Forcite 0.36122448979591837 GULP 0.04693877551020408 LUDI 0.009183673469387756 LibDock 0.07091836734693878 LigandFit 0.01683673469387755 MCSS 0.004591836734693878 MODELER 0.2770408163265306 MesoDyn 0.004081632653061225 Mesocite 0.008673469387755102 Mesoscale 0.015816326530612244 Morphology 0.023979591836734693 ONETEP 0.0035714285714285713 Polymorph 0.002551020408163265 QMERA 0.0010204081632653062 QSAR 0.002551020408163265 Quantum Mechanics 0.6678571428571428 Reflex 0.04081632653061224 Reflex Plus 0.0035714285714285713 Semi-empirical 0.011224489795918367 Sorption 0.0326530612244898 Synthia 5.102040816326531E-4 VAMP 0.00510204081632653 Visualization 1.0 X-Cell 0.0 ZDOCK 0.034183673469387756

Year

2021 0.0

Keywords

target 1.0 visualization 0.2420823436262866 docking 0.2046714172604909 potential 0.18171021377672208 between 0.15855106888361045 analysis 0.1336104513064133 novel 0.08531274742676168 binding 0.06828978622327792 activity 0.05938242280285035 experimental 0.047110055423594616 interaction 0.047110055423594616 energy 0.042359461599366585 well 0.03998416468725257 protein 0.03246239113222486 cell 0.026128266033254157 synthesized 0.024742676167854315 chemical 0.015637371338083926 mechanism 0.014647664291369754 drug 0.012074425969912905 synthesis 0.011678543151227237 compound 0.006334125098970704 promising 0.0033650039588281866 design 0.001583531274742676 surface 0.0013855898653998416 inhibition 0.0
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