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Application

Discovery Studio 1.0 Materials Studio 0.9424486803519062 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0631325910931174 Amorphous Cell 0.2754301619433198 Blends 0.0026568825910931173 CASTEP 0.3924595141700405 CDOCKER 0.18079453441295545 CHARMm 0.26568825910931176 COMPASS 0.3629807692307692 COMPASS III 0.0840080971659919 COSMObase 0.00354251012145749 COSMOconf 0.003922064777327935 COSMOmic 1.2651821862348178E-4 COSMOperm 0.0013917004048582995 COSMOplex 3.7955465587044535E-4 COSMOquick 0.0010121457489878543 COSMOtherm 0.06452429149797571 Cantera 0.0 Catalyst 0.11766194331983805 Classical Simulations 1.0 Conformers 6.325910931174089E-4 Crystallization 0.07413967611336032 DFTB Plus 0.006452429149797571 DMol3 0.17877024291497975 DPD 0.0031629554655870445 Discover 0.004048582995951417 Forcite 0.5249240890688259 GULP 0.024671052631578948 Kinetix 2.5303643724696357E-4 LUDI 0.004048582995951417 LibDock 0.07388663967611336 LigandFit 0.006072874493927126 MCSS 3.7955465587044535E-4 MODELER 0.20850202429149797 MesoDyn 0.001138663967611336 Mesocite 0.004048582995951417 Mesoscale 0.007338056680161943 Modules 0.0 Morphology 0.017459514170040488 ONETEP 8.856275303643725E-4 Polymorph 0.002403846153846154 QMERA 2.5303643724696357E-4 QSAR 0.001138663967611336 Quantum Mechanics 0.5599696356275303 Reflex 0.053770242914979755 Reflex Plus 8.856275303643725E-4 Semi-empirical 0.008350202429149798 Sorption 0.055288461538461536 Synthia 0.0020242914979757085 TURBOMOLE 3.7955465587044535E-4 VAMP 0.0013917004048582995 Visualization 0.8772773279352226 X-Cell 0.0010121457489878543 ZDOCK 0.030996963562753038

Year

2021 0.13282482903734877 2022 0.2258022093634929 2023 0.2841925302472383 2024 0.828642819568648 2025 1.0 2026 0.5147290899526565 2027 0.0

Keywords

target 1.0 potential 0.27864146037592763 docking 0.23005254319917665 visualization 0.2143437516927577 analysis 0.19202643410432804 between 0.14972103353014463 novel 0.10411136991495586 energy 0.07908563999783327 binding 0.07599804994312334 cell 0.06077677265586913 activity 0.05915172525865338 promising 0.05861004279291479 interaction 0.03634689345105899 synthesized 0.03358431287579221 stability 0.032013433725150316 experimental 0.027300796273224636 development 0.02172146687611722 protein 0.02139645739667407 performance 0.01977140999945832 effective 0.019554737013162883 mechanism 0.01700882942419154 including 0.013487893396890743 synthesis 0.013379556903743026 design 0.002275066356102053 chemical 0.0
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