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Application

Discovery Studio 1.0 Materials Studio 0.9497864980271337 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06800361881785283 Amorphous Cell 0.2743516284680338 Blends 0.002864897466827503 CASTEP 0.40719240048250904 CDOCKER 0.18101628468033776 CHARMm 0.26402291917973464 COMPASS 0.37190892641737033 COMPASS III 0.07282870928829915 COSMObase 0.002864897466827503 COSMOconf 0.0033172496984318458 COSMOmic 2.261761158021713E-4 COSMOperm 0.001281664656212304 COSMOplex 3.769601930036188E-4 COSMOquick 0.001583232810615199 COSMOtherm 0.0628015681544029 Cantera 0.0 Catalyst 0.12319059107358263 Classical Simulations 1.0 Conformers 9.800965018094089E-4 Crystallization 0.07554282267792521 DFTB Plus 0.005729794933655006 DMol3 0.18614294330518696 DPD 0.003166465621230398 Discover 0.004523522316043426 Forcite 0.528950542822678 GULP 0.026161037394451147 Kinetix 2.261761158021713E-4 LUDI 0.005579010856453559 LibDock 0.07267792521109771 LigandFit 0.008066948130277442 MCSS 0.001281664656212304 MODELER 0.19443606755126658 MesoDyn 0.001583232810615199 Mesocite 0.004297346200241255 Mesoscale 0.007840772014475271 Modules 0.0 Morphology 0.01741556091676719 ONETEP 0.0013570566948130278 Polymorph 0.0018848009650180941 QMERA 2.261761158021713E-4 QSAR 0.0013570566948130278 Quantum Mechanics 0.5814987937273823 Reflex 0.05594089264173703 Reflex Plus 6.785283474065139E-4 Semi-empirical 0.007765379975874548 Sorption 0.05390530759951749 Synthia 0.0013570566948130278 TURBOMOLE 5.277442702050664E-4 VAMP 0.0016586248492159229 Visualization 0.9012364294330518 X-Cell 0.0012062726176115801 ZDOCK 0.03121230398069964

Year

2020 0.058452922646132305 2021 0.19933496674833742 2022 0.30057752887644384 2023 0.4571228561428071 2024 0.9873993699684984 2025 1.0 2026 0.37198109905495275 2027 0.0

Keywords

target 1.0 potential 0.25875620952021633 docking 0.2189209583097529 visualization 0.21662579387536943 analysis 0.17660189901276488 between 0.1507891592781236 novel 0.10057850719989939 energy 0.07916745268188392 binding 0.07121297868326731 cell 0.05668741746840219 activity 0.054235049990567816 promising 0.04263346538388983 interaction 0.039898132427843805 synthesized 0.028485191473306925 experimental 0.026661636169276238 stability 0.024586555995724076 protein 0.02156825756146639 mechanism 0.017355215996981702 effective 0.01625479469282525 development 0.015940388605923412 synthesis 0.01304785260642646 performance 0.011381500345846696 including 0.006351002955417217 chemical 7.545746085644218E-4 design 0.0
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