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Application

Discovery Studio 1.0 Materials Studio 0.96410406885759 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06874500399680256 Amorphous Cell 0.2720490274447109 Blends 0.002930988542499334 CASTEP 0.3966160405009326 CDOCKER 0.17892352784439117 CHARMm 0.2680522248867573 COMPASS 0.3678390620836664 COMPASS III 0.07274180655475619 COSMObase 0.002398081534772182 COSMOconf 0.0037303490540900614 COSMOmic 2.664535038635758E-4 COSMOperm 0.0010658140154543032 COSMOplex 2.664535038635758E-4 COSMOquick 0.0015987210231814548 COSMOtherm 0.0606181721289635 Cantera 0.0 Catalyst 0.1189714894750866 Classical Simulations 1.0 Conformers 0.001199040767386091 Crystallization 0.07673860911270983 DFTB Plus 0.004130029309885425 DMol3 0.18238742339461764 DPD 0.002797761790567546 Discover 0.005062616573407941 Forcite 0.5281108446576073 GULP 0.023980815347721823 Kinetix 1.332267519317879E-4 LUDI 0.006261657340794031 LibDock 0.07180921929123368 LigandFit 0.007993605115907274 MCSS 0.001465494271249667 MODELER 0.1995736743938183 MesoDyn 0.001465494271249667 Mesocite 0.0045297095656807885 Mesoscale 0.0077271516120436985 Morphology 0.016919797495337063 ONETEP 0.001465494271249667 Polymorph 0.001465494271249667 QMERA 1.332267519317879E-4 QSAR 0.001332267519317879 Quantum Mechanics 0.5678124167332801 Reflex 0.05782041033839595 Reflex Plus 2.664535038635758E-4 Semi-empirical 0.005995203836930456 Sorption 0.053557154276578735 Synthia 6.661337596589396E-4 TURBOMOLE 5.329070077271516E-4 VAMP 0.001465494271249667 Visualization 0.8622435385025313 X-Cell 0.001465494271249667 ZDOCK 0.03117505995203837

Year

2020 0.00782172373081464 2021 0.2010035419126328 2022 0.25368949232585597 2023 0.3804604486422668 2024 0.8652597402597403 2025 1.0 2026 0.45233175914994095 2027 0.0

Keywords

target 1.0 potential 0.26658707146512023 docking 0.21666950935243617 visualization 0.20757291488998805 analysis 0.1802831315026437 between 0.14929785661492978 novel 0.10040366137927113 energy 0.07658195463073512 binding 0.07220421854568196 cell 0.05548922622093354 activity 0.05065666041275797 promising 0.04650633918926602 interaction 0.03644323156518278 stability 0.028085735402808575 synthesized 0.0225709250099494 experimental 0.022116095286826995 mechanism 0.01870487236340895 protein 0.01728352947865143 effective 0.01660128489396782 development 0.014838819716868498 performance 0.014042867701404288 synthesis 0.011313889362669851 including 0.01051793734720564 design 0.0023878560463926318 chemical 0.0
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