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Application

Discovery Studio 1.0 Materials Studio 0.9796732522796353 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0678471099004001 Amorphous Cell 0.278028432791351 Blends 0.0024687154167021366 CASTEP 0.3968672852643228 CDOCKER 0.17255469481569763 CHARMm 0.2601515280497148 COMPASS 0.36715757214607986 COMPASS III 0.07780709968502596 COSMObase 0.0032348684770579722 COSMOconf 0.0036605090661445475 COSMOmic 2.5538435345194517E-4 COSMOperm 0.001362049885077041 COSMOplex 3.405124712692602E-4 COSMOquick 0.001362049885077041 COSMOtherm 0.06222865412445731 Cantera 0.0 Catalyst 0.12854345790414573 Classical Simulations 1.0 Conformers 0.0010215374138077807 Crystallization 0.0751681280326892 DFTB Plus 0.005618455775942794 DMol3 0.18047160977270793 DPD 0.0030646122414233422 Discover 0.004171277773048438 Forcite 0.5326466331829404 GULP 0.025453307227377202 Kinetix 2.5538435345194517E-4 LUDI 0.005192815186856219 LibDock 0.07176300331999659 LigandFit 0.006639993189750575 MCSS 9.364092959904657E-4 MODELER 0.18064186600834256 MesoDyn 0.0015323061207116711 Mesocite 0.004256405890865753 Mesoscale 0.00774665872137567 Modules 0.0 Morphology 0.01745126415254959 ONETEP 0.0010215374138077807 Polymorph 0.0019579467097982466 QMERA 2.5538435345194517E-4 QSAR 0.0011066655316250957 Quantum Mechanics 0.5656763428960586 Reflex 0.05533327658125479 Reflex Plus 7.661530603558356E-4 Semi-empirical 0.007576402485741041 Sorption 0.05473737975653358 Synthia 0.001447178002894356 TURBOMOLE 5.107687069038903E-4 VAMP 0.0015323061207116711 Visualization 0.8672852643228058 X-Cell 0.001276921767259726 ZDOCK 0.030135353707329532

Year

2021 0.03374233128834356 2022 0.27984224364592464 2023 0.37843996494303245 2024 0.8678352322524102 2025 1.0 2026 0.37256792287467133 2027 0.0

Keywords

target 1.0 potential 0.2708030258946756 docking 0.2208684899621763 visualization 0.21203084084957813 analysis 0.18489962176316554 between 0.15289496654058773 novel 0.10197846959557753 energy 0.08433954029677045 binding 0.07321064882164678 cell 0.06139074774512657 activity 0.05331684608670352 promising 0.04989816700610998 interaction 0.03982397439627582 stability 0.03196828629618854 synthesized 0.03091358743089904 experimental 0.02909514111143439 protein 0.02116671515856852 performance 0.02105760837940064 effective 0.020039278440500435 mechanism 0.01938463776549316 development 0.01752982251963922 synthesis 0.01472941518766366 including 0.013238289205702648 design 0.0018184463194646494 chemical 0.0
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