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Application

Discovery Studio 1.0 Materials Studio 0.9850872019546718 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06571994715984147 Amorphous Cell 0.27851166886833995 Blends 0.002311756935270806 CASTEP 0.37549537648612946 CDOCKER 0.17217084984588288 CHARMm 0.2654117129018054 COMPASS 0.3561206516952884 COMPASS III 0.0845442536327609 COSMObase 0.0034125935711140465 COSMOconf 0.003963011889035667 COSMOmic 2.2016732716864817E-4 COSMOperm 9.907529722589167E-4 COSMOplex 1.1008366358432408E-4 COSMOquick 0.0015411712901805372 COSMOtherm 0.06263760457948041 Cantera 0.0 Catalyst 0.11734918538088948 Classical Simulations 1.0 Conformers 9.907529722589167E-4 Crystallization 0.07342580361074416 DFTB Plus 0.004623513870541612 DMol3 0.1695288419198591 DPD 0.002531924262439454 Discover 0.003632760898282695 Forcite 0.5317040951122853 GULP 0.022787318361955085 Kinetix 2.2016732716864817E-4 LUDI 0.005063848524878908 LibDock 0.07078379568472039 LigandFit 0.0060546014971378246 MCSS 8.806693086745927E-4 MODELER 0.20365477763099957 MesoDyn 0.001100836635843241 Mesocite 0.0034125935711140465 Mesoscale 0.006494936151475121 Modules 0.0 Morphology 0.016952884191985908 ONETEP 0.001100836635843241 Polymorph 0.0017613386173491853 QMERA 2.2016732716864817E-4 QSAR 7.705856450902686E-4 Quantum Mechanics 0.5348965213562308 Reflex 0.05416116248348745 Reflex Plus 8.806693086745927E-4 Semi-empirical 0.006384852487890797 Sorption 0.055041831792162044 Synthia 7.705856450902686E-4 TURBOMOLE 5.504183179216205E-4 VAMP 0.001321003963011889 Visualization 0.8154997798326729 X-Cell 0.001321003963011889 ZDOCK 0.028621752531924262

Year

2021 0.0033643380170195925 2022 0.14803087274886206 2023 0.24539877300613497 2024 0.6828616663368297 2025 1.0 2026 0.42054225212744906 2027 0.0

Keywords

target 1.0 potential 0.2857557858042026 docking 0.22412123559601047 visualization 0.20136535295826474 analysis 0.19826667957780575 between 0.15367483296213807 novel 0.1053548949356057 energy 0.08579451922145831 binding 0.07746683451147478 cell 0.06453955650237242 promising 0.06357122107097898 activity 0.055340369904134795 stability 0.039459668829282465 interaction 0.03524740970272102 synthesized 0.03156773506342597 performance 0.03142248474871696 experimental 0.027403892708434203 effective 0.023821051612278495 mechanism 0.023094800038733418 including 0.02067396146024983 development 0.020189793744553115 protein 0.0200445434298441 synthesis 0.014089280526774474 design 0.004405926212840128 chemical 0.0
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