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Application

Discovery Studio 1.0 Materials Studio 0.977326968973747 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06214091321439371 Amorphous Cell 0.2807680677351074 Blends 0.001965527668581796 CASTEP 0.3456304807983066 CDOCKER 0.16631387964922892 CHARMm 0.27003326277592987 COMPASS 0.3427577865134563 COMPASS III 0.09676443906864228 COSMObase 0.0042334442092530995 COSMOconf 0.005291805261566375 COSMOmic 0.0 COSMOperm 4.5358330813426064E-4 COSMOplex 1.5119443604475356E-4 COSMOquick 0.001663138796492289 COSMOtherm 0.06440882975506501 Catalyst 0.09812518899304505 Classical Simulations 1.0 Conformers 3.023888720895071E-4 Crystallization 0.06909585727245238 DFTB Plus 0.00468702751738736 DMol3 0.1575446023586332 DPD 0.001965527668581796 Discover 0.003326277592984578 Forcite 0.5284245539764136 GULP 0.019201693377683703 Kinetix 1.5119443604475356E-4 LUDI 0.003326277592984578 LibDock 0.06909585727245238 LigandFit 0.004384638645297853 MCSS 4.5358330813426064E-4 MODELER 0.24599334744481402 MesoDyn 6.047777441790142E-4 Mesocite 0.0030238887208950713 Mesoscale 0.005291805261566375 Modules 0.0 Morphology 0.01617780465678863 ONETEP 9.071666162685213E-4 Polymorph 0.001965527668581796 QMERA 1.5119443604475356E-4 QSAR 7.559721802237678E-4 Quantum Mechanics 0.4930450559419413 Reflex 0.049894163894768674 Reflex Plus 9.071666162685213E-4 Semi-empirical 0.006198971877834896 Sorption 0.05488358028424554 Synthia 9.071666162685213E-4 TURBOMOLE 4.5358330813426064E-4 VAMP 0.0010583610523132749 Visualization 0.7579377078923496 X-Cell 0.0015119443604475356 ZDOCK 0.028273359540368914

Year

2023 0.07440758293838863 2024 0.5389810426540285 2025 1.0 2026 0.5033175355450237 2027 0.0

Keywords

target 1.0 potential 0.3008510044642857 docking 0.22593470982142858 analysis 0.20947265625 visualization 0.18198939732142858 between 0.15004185267857142 novel 0.10100446428571429 energy 0.07931082589285714 promising 0.0751953125 binding 0.07470703125 cell 0.06256975446428571 activity 0.052734375 stability 0.03899274553571429 performance 0.03327287946428571 including 0.021902901785714284 synthesized 0.021623883928571428 interaction 0.01904296875 experimental 0.018415178571428572 effective 0.017578125 development 0.016880580357142856 mechanism 0.016531808035714284 protein 0.010881696428571428 enhanced 0.005719866071428571 synthesis 0.004743303571428571 design 0.0
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