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Application

Discovery Studio 1.0 Materials Studio 0.9706469540819079 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06762997169670788 Amorphous Cell 0.27536123938626544 Blends 0.0027558468642931624 CASTEP 0.41643080589900194 CDOCKER 0.17980038730820797 CHARMm 0.26120959332638166 COMPASS 0.3733800089378817 COMPASS III 0.0732161477729778 COSMObase 0.0028303292119767616 COSMOconf 0.0032772232980783555 COSMOmic 2.2344704305079697E-4 COSMOperm 0.0012661999106211828 COSMOplex 2.9792939073439596E-4 COSMOquick 0.0014896469536719798 COSMOtherm 0.06360792492179354 Cantera 7.448234768359899E-5 Catalyst 0.12326828541635633 Classical Simulations 1.0 Conformers 0.0011172352152539848 Crystallization 0.07545061820348577 DFTB Plus 0.005958587814687919 DMol3 0.1908237747653806 DPD 0.0031282586027111575 Discover 0.004915834947117533 Forcite 0.5300163861164904 GULP 0.026813645166095634 Kinetix 2.2344704305079697E-4 LUDI 0.005809623119320721 LibDock 0.07224787725309102 LigandFit 0.007969611202145092 MCSS 0.0014151646059883808 MODELER 0.19380306867272457 MesoDyn 0.0015641293013555788 Mesocite 0.004245493817965142 Mesoscale 0.007746164159094295 Modules 0.0 Morphology 0.017428869357962163 ONETEP 0.0011917175629375838 Polymorph 0.0019365410397735737 QMERA 2.2344704305079697E-4 QSAR 0.0014896469536719798 Quantum Mechanics 0.5945180992104871 Reflex 0.055712796067332045 Reflex Plus 6.703411291523909E-4 Semi-empirical 0.00804409354982869 Sorption 0.05414866676597646 Synthia 0.0014151646059883808 TURBOMOLE 5.213764337851929E-4 VAMP 0.0017130939967227767 Visualization 0.895054372113809 X-Cell 0.0011917175629375838 ZDOCK 0.03098465663637718

Year

2020 0.013900661129004916 2021 0.23843024241396846 2022 0.2930157653839634 2023 0.4373622647906425 2024 1.0 2025 0.9694015934904221 2026 0.36031530767926767 2027 0.0

Keywords

target 1.0 potential 0.2592108945061095 docking 0.2147187762335603 visualization 0.2133818362714921 analysis 0.17566769269035848 between 0.15007928364891335 novel 0.09890246556602307 energy 0.07981220657276995 binding 0.0680595715573796 cell 0.0550943630880204 activity 0.05092808506669154 promising 0.041445138824114665 interaction 0.03839815937568013 experimental 0.0267387992413643 synthesized 0.02658334110624009 stability 0.023443086776731025 protein 0.018312968317632062 mechanism 0.015763454901595 effective 0.01461306470167584 development 0.014457606566551628 performance 0.011908093150514566 synthesis 0.011752635015390355 including 0.0060317756428193885 chemical 0.0021142306376892702 design 0.0
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