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Application

Discovery Studio 0.7721081910608095 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06550218340611354 Amorphous Cell 0.2892370922167994 Blends 0.0023118417672745952 CASTEP 0.3853069612124326 CDOCKER 0.1405086051888004 CHARMm 0.2296429488826098 COMPASS 0.3704084253788852 COMPASS III 0.09452864115078345 COSMObase 0.004366812227074236 COSMOconf 0.003853069612124326 COSMOmic 0.0 COSMOperm 0.0010274852298998202 COSMOplex 0.0 COSMOquick 0.0020549704597996403 COSMOtherm 0.05985101464166453 Catalyst 0.0765476496275366 Classical Simulations 1.0 Conformers 7.706139224248652E-4 Crystallization 0.07449267916773697 DFTB Plus 0.004880554842024146 DMol3 0.17621371692781918 DPD 0.0023118417672745952 Discover 0.004109940919599281 Forcite 0.5561263806832777 GULP 0.026714615977395325 Kinetix 0.0 LUDI 0.0017980991523246853 LibDock 0.06267659902388903 LigandFit 0.0033393269971744156 MCSS 0.0 MODELER 0.21500128435653737 MesoDyn 7.706139224248652E-4 Mesocite 0.0030824556896994607 Mesoscale 0.005651168764449011 Modules 0.0 Morphology 0.016439763678397123 ONETEP 5.137426149499101E-4 Polymorph 0.0028255843822245054 QMERA 0.0 QSAR 5.137426149499101E-4 Quantum Mechanics 0.5476496275366042 Reflex 0.05445671718469047 Reflex Plus 0.0015412278448497304 Semi-empirical 0.005908040071923966 Sorption 0.060878499871564344 Synthia 0.0010274852298998202 TURBOMOLE 0.0 VAMP 5.137426149499101E-4 Visualization 0.6293347033136398 X-Cell 0.0015412278448497304 ZDOCK 0.02388903159517082

Year

2023 0.031058210898270412 2024 0.422354472754324 2025 1.0 2026 0.3959456946252557 2027 0.0

Keywords

target 1.0 potential 0.2900514364571572 analysis 0.20461673566679212 docking 0.18228578597415632 between 0.16560030109145654 visualization 0.14740935892610713 energy 0.1130347509722745 novel 0.10475473591770167 promising 0.08380378873416133 cell 0.0743946807176013 binding 0.0621001129092962 performance 0.058838288796888724 stability 0.050181909421653494 activity 0.035880065236482246 experimental 0.03487642704804918 including 0.02923096223811316 effective 0.02860368837034249 interaction 0.028101869276125957 mechanism 0.023083678333960606 synthesized 0.02258185923974407 development 0.02220549491908167 enhanced 0.015180027600050182 strong 0.005143645715719483 design 0.004390917074394681 protein 0.0
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