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Application

Discovery Studio 0.8769780142837138 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06961190655614168 Amorphous Cell 0.2863602110022607 Blends 0.002543330821401658 CASTEP 0.39883195177091185 CDOCKER 0.15099849284099473 CHARMm 0.23709495101733233 COMPASS 0.3743406179351922 COMPASS III 0.08223436322532027 COSMObase 0.003485305199698568 COSMOconf 0.003956292388847023 COSMOmic 1.8839487565938207E-4 COSMOperm 0.0013187641296156744 COSMOplex 1.8839487565938207E-4 COSMOquick 0.0013187641296156744 COSMOtherm 0.06433685003767897 Cantera 0.0 Catalyst 0.11228334589299171 Classical Simulations 1.0 Conformers 8.477769404672192E-4 Crystallization 0.07620572720422004 DFTB Plus 0.005651846269781462 DMol3 0.1818010550113037 DPD 0.002825923134890731 Discover 0.00367370007535795 Forcite 0.5507724189902035 GULP 0.02552750565184627 Kinetix 2.825923134890731E-4 LUDI 0.003956292388847023 LibDock 0.06443104747550867 LigandFit 0.005180859080633007 MCSS 5.651846269781462E-4 MODELER 0.1743594574227581 MesoDyn 0.0013187641296156744 Mesocite 0.004050489826676714 Mesoscale 0.0073474001507159 Modules 0.0 Morphology 0.017897513187641295 ONETEP 0.0010361718161266014 Polymorph 0.0017897513187641297 QMERA 1.8839487565938207E-4 QSAR 0.0010361718161266014 Quantum Mechanics 0.5693293142426527 Reflex 0.05595327807083647 Reflex Plus 8.477769404672192E-4 Semi-empirical 0.0076299924642049734 Sorption 0.05708364732479276 Synthia 0.0015071590052750565 TURBOMOLE 5.651846269781462E-4 VAMP 0.0016013564431047475 Visualization 0.7640354182366239 X-Cell 0.0013187641296156744 ZDOCK 0.026281085154483796

Year

2022 0.046474921080322695 2023 0.35592774465099963 2024 0.755699754472115 2025 1.0 2026 0.3727639424763241 2027 0.0

Keywords

target 1.0 potential 0.2727542624480448 docking 0.19810840614131817 analysis 0.1874628891339384 visualization 0.1843667825939435 between 0.1573924845194673 novel 0.09606412757655441 energy 0.09508864195436424 cell 0.06408516413605904 binding 0.06098905759606413 promising 0.055136143862923065 activity 0.04381202816184579 stability 0.03728051573500721 performance 0.034947832725422005 interaction 0.033760285011451355 experimental 0.032063788277207565 synthesized 0.027695309186529817 effective 0.020145898719144965 mechanism 0.019509712443803544 development 0.017389091525998813 including 0.016201543812028162 protein 0.007931122232589701 synthesis 0.007506998049028756 chemical 8.482483671218933E-5 design 0.0
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