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Application

Discovery Studio 1.0 Materials Studio 0.9618708079038009 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06745571925177951 Amorphous Cell 0.27594769077967224 Blends 0.002400264856811786 CASTEP 0.3998510180433703 CDOCKER 0.17670915411355737 CHARMm 0.26220824366826684 COMPASS 0.36699221983115377 COMPASS III 0.07614633338851183 COSMObase 0.0031451746399602716 COSMOconf 0.0035590134083760966 COSMOmic 2.4830326104949513E-4 COSMOperm 0.0014070518126138058 COSMOplex 3.3107101473266014E-4 COSMOquick 0.0014070518126138058 COSMOtherm 0.06257242178447277 Cantera 0.0 Catalyst 0.12920046349942063 Classical Simulations 1.0 Conformers 9.932130441979805E-4 Crystallization 0.07540142360536335 DFTB Plus 0.005793742757821553 DMol3 0.18126138056613145 DPD 0.0031451746399602716 Discover 0.004221155437841417 Forcite 0.5309551398775038 GULP 0.025740771395464327 Kinetix 2.4830326104949513E-4 LUDI 0.005214368482039398 LibDock 0.07209071345803675 LigandFit 0.006786955802019533 MCSS 9.932130441979805E-4 MODELER 0.18614467803343818 MesoDyn 0.0016553550736633008 Mesocite 0.004303923191524582 Mesoscale 0.007945704353583844 Modules 0.0 Morphology 0.017546763780830987 ONETEP 9.932130441979805E-4 Polymorph 0.002069193842079126 QMERA 2.4830326104949513E-4 QSAR 0.0010759807978811455 Quantum Mechanics 0.5692766098328091 Reflex 0.05537162721403741 Reflex Plus 7.449097831484854E-4 Semi-empirical 0.007780168846217513 Sorption 0.05487502069193842 Synthia 0.0014070518126138058 TURBOMOLE 4.966065220989903E-4 VAMP 0.0015725873199801358 Visualization 0.8834630028141036 X-Cell 0.0012415163052474755 ZDOCK 0.03070683661645423

Year

2021 0.08648790746582545 2022 0.29547844374342797 2023 0.3787241500175254 2024 0.9108832807570978 2025 1.0 2026 0.3725026288117771 2027 0.0

Keywords

target 1.0 potential 0.26916083916083916 docking 0.22325174825174826 visualization 0.215 analysis 0.18416083916083917 between 0.15174825174825174 novel 0.10181818181818182 energy 0.08234265734265735 binding 0.07384615384615385 cell 0.05937062937062937 activity 0.054265734265734264 promising 0.04818181818181818 interaction 0.04010489510489511 stability 0.030874125874125875 synthesized 0.030524475524475524 experimental 0.028496503496503497 protein 0.021713286713286713 mechanism 0.019195804195804196 effective 0.018916083916083917 performance 0.01888111888111888 development 0.017552447552447552 synthesis 0.014685314685314685 including 0.012027972027972029 design 0.0018181818181818182 chemical 0.0
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