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Application

Discovery Studio 1.0 Materials Studio 0.9548166151126822 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0688832562993887 Amorphous Cell 0.2718055762636052 Blends 0.0023855673177277472 CASTEP 0.38243626062322944 CDOCKER 0.17623378559713732 CHARMm 0.2718055762636052 COMPASS 0.3596242731474579 COMPASS III 0.0735052929774862 COSMObase 0.0025346652750857313 COSMOconf 0.0034292530192336365 COSMOmic 2.981959147159684E-4 COSMOperm 0.0011927836588638736 COSMOplex 0.0 COSMOquick 0.001490979573579842 COSMOtherm 0.05934098702847771 Cantera 0.0 Catalyst 0.12330401073505293 Classical Simulations 1.0 Conformers 0.0011927836588638736 Crystallization 0.07529446846578201 DFTB Plus 0.0037274489339496047 DMol3 0.1725063366631877 DPD 0.0026837632324437154 Discover 0.0047711346354554944 Forcite 0.527657671089906 GULP 0.022961085433129566 Kinetix 1.490979573579842E-4 LUDI 0.006262114209035336 LibDock 0.07201431340390636 LigandFit 0.007156701953183241 MCSS 0.0013418816162218577 MODELER 0.19218726703444164 MesoDyn 0.001490979573579842 Mesocite 0.004025644848665574 Mesoscale 0.007305799910541226 Morphology 0.016549873266736247 ONETEP 0.0010436857015058893 Polymorph 0.001490979573579842 QMERA 1.490979573579842E-4 QSAR 0.0010436857015058893 Quantum Mechanics 0.5436111525272104 Reflex 0.056657223796033995 Reflex Plus 2.981959147159684E-4 Semi-empirical 0.0056657223796034 Sorption 0.053078872819442374 Synthia 2.981959147159684E-4 TURBOMOLE 5.963918294319368E-4 VAMP 0.001490979573579842 Visualization 0.8501565528552258 X-Cell 0.0013418816162218577 ZDOCK 0.03056508125838676

Year

2021 0.058476881233000905 2022 0.25234209731036567 2023 0.3268359020852221 2024 0.8058325778180719 2025 1.0 2026 0.40737382895134483 2027 0.0

Keywords

target 1.0 potential 0.2754806764838274 docking 0.22545173943797828 visualization 0.2087325573918076 analysis 0.18924827985338563 between 0.15040833386920455 novel 0.1038518423252524 energy 0.07915889653398495 binding 0.07896598289499067 cell 0.059353096263905857 activity 0.05311555526975757 promising 0.05105780978715195 interaction 0.03871133689151823 stability 0.03221657771204424 synthesized 0.026879300366535915 experimental 0.024757250337598867 protein 0.021413413928364735 mechanism 0.020963282104044755 effective 0.020191627548067647 performance 0.018519709343450583 development 0.016140441129187832 including 0.015626004758536427 synthesis 0.014661436563565044 design 0.0030223136775770045 chemical 0.0
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