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Application

Discovery Studio 1.0 Materials Studio 0.9809319188935142 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06569211333694279 Amorphous Cell 0.2782891174878181 Blends 0.0024363833243096914 CASTEP 0.4027251398664501 CDOCKER 0.1728929796065692 CHARMm 0.26150514347590686 COMPASS 0.3642844251940083 COMPASS III 0.0800397040245443 COSMObase 0.003338747518498466 COSMOconf 0.003880166035011731 COSMOmic 9.023641941887746E-5 COSMOperm 0.0013535462912831618 COSMOplex 2.707092582566324E-4 COSMOquick 0.0013535462912831618 COSMOtherm 0.06497022198159177 Cantera 9.023641941887746E-5 Catalyst 0.12353365818444324 Classical Simulations 1.0 Conformers 9.023641941887746E-4 Crystallization 0.07273055405161523 DFTB Plus 0.006226312939902545 DMol3 0.18191662154845695 DPD 0.002977801840822956 Discover 0.004421584551524996 Forcite 0.5306803826024183 GULP 0.025266197437285687 Kinetix 1.8047283883775492E-4 LUDI 0.005233712326294893 LibDock 0.0716477170185887 LigandFit 0.006677495036996932 MCSS 0.001173073452445407 MODELER 0.19806894062443603 MesoDyn 0.0013535462912831618 Mesocite 0.003880166035011731 Mesoscale 0.007218913553510196 Modules 0.0 Morphology 0.017325392528424473 ONETEP 9.92600613607652E-4 Polymorph 0.0020754376466341814 QMERA 1.8047283883775492E-4 QSAR 0.0013535462912831618 Quantum Mechanics 0.5723696083739397 Reflex 0.05287854177946219 Reflex Plus 8.121277747698972E-4 Semi-empirical 0.008211514167117849 Sorption 0.05414185165132648 Synthia 0.0015340191301209168 TURBOMOLE 5.414185165132648E-4 VAMP 0.0016242555495397943 Visualization 0.863021115322144 X-Cell 0.0012633098718642843 ZDOCK 0.029597545569391807

Year

2020 0.0 2021 0.11463220323979818 2022 0.1534035584668496 2023 0.3873594759670709 2024 0.7716207842790122 2025 1.0 2026 0.37638311056032575 2027 1.7703815172169602E-4

Keywords

target 1.0 potential 0.27167317280562747 docking 0.2191087233795849 visualization 0.20774552622424922 analysis 0.18443937695667298 between 0.15007923317744368 novel 0.09952460093533799 energy 0.08170679859312797 binding 0.06926139218490318 cell 0.0578981950295675 activity 0.05109573686855023 promising 0.04974297530243883 interaction 0.035210451049356474 stability 0.02836934255787887 synthesized 0.028098790244656592 experimental 0.027403084296370735 protein 0.01897731225601979 performance 0.018165655316352954 development 0.017353998376686122 effective 0.0154987825145905 mechanism 0.014996328218606268 including 0.010976693850732423 synthesis 0.010899393189811772 design 2.3190198276195262E-4 chemical 0.0
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