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Application

Discovery Studio 1.0 Materials Studio 0.966888418506199 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06336822074215033 Amorphous Cell 0.27554709800190297 Blends 0.001522359657469077 CASTEP 0.33282588011417696 CDOCKER 0.16974310180780208 CHARMm 0.27764034253092296 COMPASS 0.33910561370123693 COMPASS III 0.09647954329210276 COSMObase 0.004567078972407232 COSMOconf 0.005518553758325404 COSMOmic 0.0 COSMOperm 5.70884871550904E-4 COSMOplex 1.9029495718363463E-4 COSMOquick 0.001522359657469077 COSMOtherm 0.06412940057088487 Catalyst 0.08981921979067554 Classical Simulations 1.0 Conformers 1.9029495718363463E-4 Crystallization 0.06964795432921028 DFTB Plus 0.004376784015223597 DMol3 0.15299714557564226 DPD 0.0020932445290199808 Discover 0.003805899143672693 Forcite 0.5235014272121788 GULP 0.018268315889628926 Kinetix 0.0 LUDI 0.003805899143672693 LibDock 0.07193149381541389 LigandFit 0.0041864890580399616 MCSS 5.70884871550904E-4 MODELER 0.2570884871550904 MesoDyn 5.70884871550904E-4 Mesocite 0.0032350142721217887 Mesoscale 0.005518553758325404 Morphology 0.01560418648905804 ONETEP 7.611798287345385E-4 Polymorph 0.0019029495718363464 QMERA 1.9029495718363463E-4 QSAR 7.611798287345385E-4 Quantum Mechanics 0.4772597526165557 Reflex 0.05099904852521408 Reflex Plus 7.611798287345385E-4 Semi-empirical 0.005899143672692674 Sorption 0.05195052331113226 Synthia 7.611798287345385E-4 TURBOMOLE 3.8058991436726926E-4 VAMP 9.514747859181732E-4 Visualization 0.7345385347288297 X-Cell 0.0017126546146527116 ZDOCK 0.029495718363463368

Year

2023 0.02877044215626893 2024 0.4762265293761357 2025 1.0 2026 0.6187159297395518 2027 0.0

Keywords

target 1.0 potential 0.30656670580796674 docking 0.2269894318489748 analysis 0.2147050853581429 visualization 0.1747809592629392 between 0.14759281004425978 novel 0.09628759822960889 promising 0.07966760003613044 binding 0.07777075241622257 energy 0.07352542679071448 cell 0.05853129798572848 activity 0.04868575557763526 stability 0.03902086532381899 performance 0.02827206214434107 including 0.022491193207479 effective 0.017432932887724687 synthesized 0.01616836780778611 development 0.0140908680336013 interaction 0.0140908680336013 experimental 0.011110107488031795 mechanism 0.010839129256616386 protein 0.008490651251016168 strong 0.004696956011200433 enhanced 0.004245325625508084 synthesis 0.0
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