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Application

Discovery Studio 1.0 Materials Studio 0.9937680215793879 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06587757054041128 Amorphous Cell 0.2786944045911047 Blends 0.0023912003825920613 CASTEP 0.3680057388809182 CDOCKER 0.17216642754662842 CHARMm 0.2661406025824964 COMPASS 0.3518651362984218 COMPASS III 0.0859636537541846 COSMObase 0.003586800573888092 COSMOconf 0.00430416068866571 COSMOmic 1.1956001912960307E-4 COSMOperm 8.369201339072215E-4 COSMOplex 1.1956001912960307E-4 COSMOquick 0.0011956001912960307 COSMOtherm 0.06133428981348637 Cantera 0.0 Catalyst 0.11358201817312291 Classical Simulations 1.0 Conformers 9.564801530368245E-4 Crystallization 0.07293161166905787 DFTB Plus 0.004662840746054519 DMol3 0.16642754662840745 DPD 0.0026303204208512673 Discover 0.0034672405547584886 Forcite 0.5316834050693449 GULP 0.022118603538976565 Kinetix 2.3912003825920613E-4 LUDI 0.005380200860832138 LibDock 0.07089909134385461 LigandFit 0.005978000956480153 MCSS 9.564801530368245E-4 MODELER 0.19858919177427067 MesoDyn 0.0011956001912960307 Mesocite 0.003706360593017695 Mesoscale 0.006934481109516977 Modules 0.0 Morphology 0.016618842659014827 ONETEP 9.564801530368245E-4 Polymorph 0.001673840267814443 QMERA 2.3912003825920613E-4 QSAR 7.173601147776184E-4 Quantum Mechanics 0.5251076040172167 Reflex 0.05380200860832138 Reflex Plus 7.173601147776184E-4 Semi-empirical 0.006456241032998565 Sorption 0.054878048780487805 Synthia 8.369201339072215E-4 TURBOMOLE 5.978000956480153E-4 VAMP 0.0013151602104256336 Visualization 0.7961501673840268 X-Cell 0.0013151602104256336 ZDOCK 0.028813964610234336

Year

2021 0.0013091861226271003 2022 0.15841152083787913 2023 0.23565350207287802 2024 0.6465197468906829 2025 1.0 2026 0.4633427885664412 2027 0.0

Keywords

target 1.0 potential 0.2851575013347571 docking 0.2234383342231714 analysis 0.1995194874532835 visualization 0.19834490122797652 between 0.15248264815803525 novel 0.10453817405232248 energy 0.08494394020288308 binding 0.07778964228510411 cell 0.06609717031500267 promising 0.06460224239188468 activity 0.05403096636412173 stability 0.04105712760277629 interaction 0.03454351308061933 performance 0.03368926855312333 synthesized 0.029311265349706354 experimental 0.027175654030966365 effective 0.024826481580352375 mechanism 0.023117992525360384 including 0.020982381206620396 protein 0.019861185264281902 development 0.019594233849439403 synthesis 0.013454351308061933 design 0.00592632140950347 chemical 0.0
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