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Application

Discovery Studio 1.0 Materials Studio 0.550160656908247 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07838616714697406 Amorphous Cell 0.30144092219020174 Blends 0.0023054755043227667 CASTEP 0.14121037463976946 CDOCKER 0.18559077809798272 CHARMm 0.34697406340057635 COMPASS 0.3585014409221902 COMPASS III 0.06685878962536022 COSMObase 0.0023054755043227667 COSMOconf 0.00345821325648415 COSMOmic 0.0 COSMOperm 5.763688760806917E-4 COSMOquick 0.0011527377521613833 COSMOtherm 0.04899135446685879 Catalyst 0.11354466858789625 Classical Simulations 1.0 Crystallization 0.03976945244956772 DFTB Plus 0.008645533141210375 DMol3 0.1256484149855908 DPD 0.0023054755043227667 Discover 0.004610951008645533 Forcite 0.49221902017291064 GULP 0.011527377521613832 LUDI 0.005187319884726225 LibDock 0.08011527377521614 LigandFit 0.001729106628242075 MODELER 0.23746397694524496 MesoDyn 5.763688760806917E-4 Mesocite 0.005763688760806916 Mesoscale 0.007492795389048991 Morphology 0.015561959654178675 ONETEP 0.001729106628242075 Polymorph 0.0011527377521613833 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.25417867435158503 Reflex 0.023054755043227664 Reflex Plus 0.0 Semi-empirical 0.011527377521613832 Sorption 0.05187319884726225 Synthia 0.0011527377521613833 TURBOMOLE 0.0 VAMP 0.001729106628242075 Visualization 0.9487031700288184 X-Cell 0.0 ZDOCK 0.057060518731988474

Year

2022 0.14094775212636695 2023 0.551640340218712 2024 0.8596597812879708 2025 1.0 2026 0.24362089914945323 2027 0.0

Keywords

interaction 1.0 target 0.9487047961015646 between 0.4098486791484996 docking 0.3657348037958451 potential 0.3157219799948705 analysis 0.2739163888176456 visualization 0.24416517055655296 binding 0.21928699666581175 protein 0.10746345216722236 energy 0.09976917158245704 mechanism 0.091048986919723 novel 0.06463195691202872 cell 0.06206719671710695 stability 0.05180815593741985 activity 0.04744806360605283 experimental 0.030007694280584765 including 0.02564760194921775 complex 0.023595793793280327 drug 0.023595793793280327 development 0.018979225442421133 promising 0.013080276994101052 effective 0.010771992818671455 strong 0.010771992818671455 silico 0.009489612721210567 therapeutic 0.0
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