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Application

Discovery Studio 1.0 Materials Studio 0.9377782174300129 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06680189317106153 Amorphous Cell 0.2713995943204868 Blends 0.002434077079107505 CASTEP 0.38025693035835023 CDOCKER 0.17958079783637593 CHARMm 0.27410412440838405 COMPASS 0.3592968221771467 COMPASS III 0.07640297498309669 COSMObase 0.0029749830966869506 COSMOconf 0.004056795131845842 COSMOmic 2.704530087897228E-4 COSMOperm 0.0010818120351588911 COSMOplex 2.704530087897228E-4 COSMOquick 0.001352265043948614 COSMOtherm 0.06044624746450304 Cantera 0.0 Catalyst 0.12008113590263692 Classical Simulations 1.0 Conformers 0.0012170385395537525 Crystallization 0.07518593644354293 DFTB Plus 0.004192021636240703 DMol3 0.17214334009465856 DPD 0.002434077079107505 Discover 0.004462474645030426 Forcite 0.523867478025693 GULP 0.02244759972954699 Kinetix 1.352265043948614E-4 LUDI 0.006355645706558485 LibDock 0.07261663286004057 LigandFit 0.006896551724137931 MCSS 0.0012170385395537525 MODELER 0.20405679513184585 MesoDyn 0.001352265043948614 Mesocite 0.004192021636240703 Mesoscale 0.007167004732927654 Morphology 0.016903313049357674 ONETEP 9.465855307640297E-4 Polymorph 0.0016227180527383367 QMERA 1.352265043948614E-4 QSAR 9.465855307640297E-4 Quantum Mechanics 0.5413116970926302 Reflex 0.05611899932386748 Reflex Plus 2.704530087897228E-4 Semi-empirical 0.006085192697768763 Sorption 0.05354969574036511 Synthia 5.409060175794456E-4 TURBOMOLE 5.409060175794456E-4 VAMP 0.0014874915483434753 Visualization 0.8554428668018932 X-Cell 0.001352265043948614 ZDOCK 0.030831643002028397

Year

2021 0.10702479338842975 2022 0.23457300275482093 2023 0.29793388429752066 2024 0.7524793388429752 2025 1.0 2026 0.4888429752066116 2027 0.0

Keywords

target 1.0 potential 0.2835244558857945 docking 0.23092674935642407 visualization 0.21296512988532648 analysis 0.19529604493330213 between 0.15129885326468523 novel 0.10566346828925813 binding 0.08255324128247134 energy 0.08073952726421718 cell 0.061022700678680084 activity 0.058097355487947575 promising 0.05616662766206412 interaction 0.040311256728293936 stability 0.03685934940322958 synthesized 0.028258834542476012 experimental 0.024923941025040953 protein 0.024221858179265154 effective 0.023812309852562604 mechanism 0.0227591855838989 performance 0.021647554411420546 including 0.019190264451205242 development 0.01913175754739059 synthesis 0.016323426164287384 design 0.006084717996723613 chemical 0.0
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