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Application

Discovery Studio 0.9124876394971041 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0686470532228887 Amorphous Cell 0.2823002951537656 Blends 0.002570694087403599 CASTEP 0.4070265638389032 CDOCKER 0.15728839379224982 CHARMm 0.24507283633247642 COMPASS 0.37037037037037035 COMPASS III 0.08245263258116728 COSMObase 0.003522803008664191 COSMOconf 0.003998857469294488 COSMOmic 1.9042178425211843E-4 COSMOperm 0.001332952489764829 COSMOplex 2.8563267637817766E-4 COSMOquick 0.0015233742740169475 COSMOtherm 0.06426735218508997 Cantera 9.521089212605922E-5 Catalyst 0.10968294772922023 Classical Simulations 1.0 Conformers 9.521089212605922E-4 Crystallization 0.07521660477958679 DFTB Plus 0.0057126535275635534 DMol3 0.1853756069694373 DPD 0.002665904979529658 Discover 0.004189279253546605 Forcite 0.5431781395791678 GULP 0.02580215176616205 Kinetix 2.8563267637817766E-4 LUDI 0.004284490145672665 LibDock 0.06683804627249357 LigandFit 0.005141388174807198 MCSS 0.0010473198133866513 MODELER 0.18604208321431973 MesoDyn 0.0015233742740169475 Mesocite 0.003808435685042369 Mesoscale 0.007140816909454442 Modules 0.0 Morphology 0.01723317147481672 ONETEP 0.0011425307055127106 Polymorph 0.001999428734647244 QMERA 1.9042178425211843E-4 QSAR 0.0010473198133866513 Quantum Mechanics 0.580310387508331 Reflex 0.05531752832524041 Reflex Plus 8.56898029134533E-4 Semi-empirical 0.007712082262210797 Sorption 0.057793011520517946 Synthia 0.0016185851661430068 TURBOMOLE 6.664762448824145E-4 VAMP 0.0016185851661430068 Visualization 0.792535466057317 X-Cell 0.001332952489764829 ZDOCK 0.027325526040178995

Year

2021 0.028568893620796735 2022 0.147458078253926 2023 0.2727353384792831 2024 0.7565433413184278 2025 1.0 2026 0.3771626297577855 2027 0.0

Keywords

target 1.0 potential 0.2709193561978596 docking 0.20388472233926014 visualization 0.190401955001264 analysis 0.18412404145950956 between 0.15686357124799866 novel 0.09800286508805932 energy 0.09159855060251117 binding 0.06202072975478217 cell 0.05999831465408275 promising 0.05401533664784697 activity 0.04390326114434988 interaction 0.03417038847223393 stability 0.03311704727395298 experimental 0.030968231229459846 performance 0.029872756383247663 synthesized 0.02709193561978596 effective 0.017401196595601246 mechanism 0.017232662003876294 development 0.016179320805595348 including 0.013103564506614982 protein 0.010112075503497093 synthesis 0.00716272014831044 design 0.0010533411982809472 chemical 0.0
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