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Application

Discovery Studio 1.0 Materials Studio 0.9354009595613434 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0649895178197065 Amorphous Cell 0.27242021896109947 Blends 0.0023293733985557887 CASTEP 0.378872583275099 CDOCKER 0.17528534824132308 CHARMm 0.27638015373864433 COMPASS 0.34963894712322385 COMPASS III 0.08455625436757512 COSMObase 0.003610528767761472 COSMOconf 0.004658746797111577 COSMOmic 1.1646866992778943E-4 COSMOperm 0.0015140927090612625 COSMOplex 2.3293733985557886E-4 COSMOquick 0.001630561378989052 COSMOtherm 0.06440717447006755 Cantera 0.0 Catalyst 0.1278825995807128 Classical Simulations 1.0 Conformers 6.988120195667365E-4 Crystallization 0.07209410668530165 DFTB Plus 0.006172839506172839 DMol3 0.16643372932681108 DPD 0.002678779408339157 Discover 0.003028185418122525 Forcite 0.52212904728628 GULP 0.022944327975774517 Kinetix 2.3293733985557886E-4 LUDI 0.004425809457255998 LibDock 0.07430701141392965 LigandFit 0.005474027486606103 MCSS 5.823433496389472E-4 MODELER 0.20463545306312603 MesoDyn 0.0010482180293501049 Mesocite 0.0029117167481947357 Mesoscale 0.006172839506172839 Modules 0.0 Morphology 0.017586769159096204 ONETEP 0.0011646866992778943 Polymorph 0.0018634987188446308 QMERA 0.0 QSAR 0.0011646866992778943 Quantum Mechanics 0.5348241323084091 Reflex 0.0518285581178663 Reflex Plus 9.317493594223154E-4 Semi-empirical 0.007686932215234102 Sorption 0.05567202422548335 Synthia 0.0015140927090612625 TURBOMOLE 5.823433496389472E-4 VAMP 0.0012811553692056836 Visualization 0.8524341952014908 X-Cell 0.001397624039133473 ZDOCK 0.029466573491730725

Year

2022 0.015286270150083379 2023 0.342875671669446 2024 0.5653140633685381 2025 1.0 2026 0.32406892718176766 2027 0.0

Keywords

target 1.0 potential 0.2755256677401023 docking 0.22115931047546883 visualization 0.19809623034665658 analysis 0.18493085811706764 between 0.14301951127107407 novel 0.10196059859821936 binding 0.07648228831218033 energy 0.07634021594999053 promising 0.06189619246069331 cell 0.05806023868156848 activity 0.05730251941655617 interaction 0.03442886910399697 stability 0.03400265201742754 synthesized 0.031871566584580416 experimental 0.02462587611290017 protein 0.024389088842583822 performance 0.023299867399128624 development 0.02225800340973669 effective 0.02121613942034476 including 0.0191324114415609 mechanism 0.019085053987497633 synthesis 0.01733282818715666 design 0.0029361621519227127 compound 0.0
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