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Application

Discovery Studio 0.8878015630309208 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06972913616398244 Amorphous Cell 0.2862371888726208 Blends 0.002562225475841874 CASTEP 0.4005307467057101 CDOCKER 0.15428257686676428 CHARMm 0.23837847730600292 COMPASS 0.37463396778916547 COMPASS III 0.0808931185944363 COSMObase 0.0033857979502196194 COSMOconf 0.0038433382137628112 COSMOmic 2.745241581259151E-4 COSMOperm 0.0014641288433382138 COSMOplex 2.745241581259151E-4 COSMOquick 0.001281112737920937 COSMOtherm 0.06405563689604685 Cantera 0.0 Catalyst 0.11411054172767203 Classical Simulations 1.0 Conformers 9.150805270863836E-4 Crystallization 0.07650073206442166 DFTB Plus 0.005765007320644217 DMol3 0.18301610541727673 DPD 0.003019765739385066 Discover 0.0036603221083455345 Forcite 0.5494143484626647 GULP 0.026171303074670572 Kinetix 2.745241581259151E-4 LUDI 0.004117862371888726 LibDock 0.06597730600292825 LigandFit 0.005215959004392387 MCSS 5.490483162518302E-4 MODELER 0.17166910688140558 MesoDyn 0.0013726207906295754 Mesocite 0.004117862371888726 Mesoscale 0.007503660322108346 Modules 0.0 Morphology 0.018027086383601756 ONETEP 0.001006588579795022 Polymorph 0.0018301610541727673 QMERA 1.8301610541727673E-4 QSAR 0.001006588579795022 Quantum Mechanics 0.5723828696925329 Reflex 0.05618594436310395 Reflex Plus 8.235724743777453E-4 Semi-empirical 0.0076866764275256225 Sorption 0.05691800878477306 Synthia 0.0014641288433382138 TURBOMOLE 5.490483162518302E-4 VAMP 0.0015556368960468522 Visualization 0.7752562225475842 X-Cell 0.001281112737920937 ZDOCK 0.02681185944363104

Year

2022 0.08941877794336811 2023 0.36170772332778117 2024 0.7961777855702639 2025 1.0 2026 0.37266590689927237 2027 0.0

Keywords

target 1.0 potential 0.2697400686611084 docking 0.19891286578388098 visualization 0.18714239006048716 analysis 0.1859980382540461 between 0.15608141245708682 novel 0.09571685466732058 energy 0.09334641163969266 cell 0.06530979238188654 binding 0.061222821644597025 promising 0.053784534902730094 activity 0.04487493869543894 stability 0.03710969429458885 interaction 0.03449403302272356 performance 0.03290011443518064 experimental 0.03196011116560406 synthesized 0.027668791891450058 effective 0.019985286905345758 mechanism 0.019862677783227072 development 0.016756580022887036 including 0.015285270557462809 protein 0.008909596207291155 synthesis 0.008746117377799576 chemical 0.0 design 0.0
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