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Application

Discovery Studio 0.9317678334071776 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06961296007591676 Amorphous Cell 0.28075645631397006 Blends 0.0029824442486273976 CASTEP 0.42906527485935064 CDOCKER 0.16701687792313427 CHARMm 0.2436792516776249 COMPASS 0.38642987866874534 COMPASS III 0.06961296007591676 COSMObase 0.002575747305632753 COSMOconf 0.0031180098962922797 COSMOmic 2.7113129532976344E-4 COSMOperm 0.0012878736528163764 COSMOplex 4.0669694299464516E-4 COSMOquick 0.0016267877719785807 COSMOtherm 0.06581712194130007 Cantera 6.778282383244086E-5 Catalyst 0.11333288144784112 Classical Simulations 1.0 Conformers 0.0015590049481461398 Crystallization 0.07903477258862604 DFTB Plus 0.006100454144919678 DMol3 0.20097607266318715 DPD 0.003321358367789602 Discover 0.005897105673422355 Forcite 0.540906934182878 GULP 0.028739917304954926 Kinetix 2.0334847149732258E-4 LUDI 0.0055581915542601504 LibDock 0.06724056124178134 LigandFit 0.00793059038839558 MCSS 0.0013556564766488172 MODELER 0.18199688199010372 MesoDyn 0.002033484714973226 Mesocite 0.004473666372941097 Mesoscale 0.008472852979055107 Modules 0.0 Morphology 0.01897919067308344 ONETEP 0.0013556564766488172 Polymorph 0.001897919067308344 QMERA 4.0669694299464516E-4 QSAR 0.0017623534196434623 Quantum Mechanics 0.616688131227547 Reflex 0.05808988002440182 Reflex Plus 8.133938859892903E-4 Semi-empirical 0.00867620145055243 Sorption 0.055717481190266385 Synthia 0.0014912221243136988 TURBOMOLE 6.778282383244086E-4 VAMP 0.002033484714973226 Visualization 0.8426082830610723 X-Cell 0.0012200908289839354 ZDOCK 0.029011048600284688

Year

2020 0.05933564364804328 2021 0.23539852928746513 2022 0.29448060180880736 2023 0.6476206575944552 2024 1.0 2025 0.9666976586932634 2026 0.35931028653537317 2027 0.0

Keywords

target 1.0 potential 0.2459768796075844 visualization 0.19878947821347637 docking 0.19620779667823643 analysis 0.1677806144402054 between 0.15295028828777144 novel 0.09311264737098764 energy 0.08625684862740599 binding 0.05992369696795846 cell 0.057829666389374944 activity 0.04526548291787384 interaction 0.03780729181606953 promising 0.03769255041450331 experimental 0.031525200080318984 synthesized 0.024956254840652878 stability 0.022030349100714264 mechanism 0.017870973293938785 performance 0.015203235707524167 effective 0.01419924844381974 development 0.012248644617193999 protein 0.012162588566019334 synthesis 0.00894982932216517 chemical 0.003671724850119044 including 0.003356185995811939 design 0.0
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