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Application

Discovery Studio 1.0 Materials Studio 0.962696125520333 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06531049250535331 Amorphous Cell 0.2750535331905782 Blends 0.002355460385438972 CASTEP 0.3810492505353319 CDOCKER 0.16937901498929336 CHARMm 0.26680942184154177 COMPASS 0.3537473233404711 COMPASS III 0.08533190578158459 COSMObase 0.003747323340471092 COSMOconf 0.004496788008565311 COSMOmic 1.0706638115631691E-4 COSMOperm 0.00139186295503212 COSMOplex 2.1413276231263382E-4 COSMOquick 0.0014989293361884369 COSMOtherm 0.0632762312633833 Cantera 0.0 Catalyst 0.12569593147751607 Classical Simulations 1.0 Conformers 6.423982869379015E-4 Crystallization 0.07205567451820129 DFTB Plus 0.005781584582441114 DMol3 0.16927194860813705 DPD 0.002462526766595289 Discover 0.0032119914346895075 Forcite 0.528372591006424 GULP 0.023126338329764455 Kinetix 2.1413276231263382E-4 LUDI 0.004389721627408994 LibDock 0.07226980728051392 LigandFit 0.005674518201284797 MCSS 6.423982869379015E-4 MODELER 0.19764453961456102 MesoDyn 9.635974304068523E-4 Mesocite 0.0032119914346895075 Mesoscale 0.006209850107066381 Modules 0.0 Morphology 0.017237687366167022 ONETEP 0.0010706638115631692 Polymorph 0.0019271948608137045 QMERA 1.0706638115631691E-4 QSAR 0.0010706638115631692 Quantum Mechanics 0.5394004282655246 Reflex 0.052141327623126336 Reflex Plus 9.635974304068523E-4 Semi-empirical 0.007280513918629551 Sorption 0.05599571734475375 Synthia 0.0014989293361884369 TURBOMOLE 5.353319057815846E-4 VAMP 0.001177730192719486 Visualization 0.8490364025695931 X-Cell 0.00139186295503212 ZDOCK 0.029336188436830835

Year

2022 0.03899326479971641 2023 0.3565225097483162 2024 0.5586671393123006 2025 1.0 2026 0.37672811059907835 2027 0.0

Keywords

target 1.0 potential 0.2897069802164987 docking 0.2320828667413214 visualization 0.2123926838372527 analysis 0.1996080627099664 between 0.15369540873460247 novel 0.10530981709593132 energy 0.08571295259425159 binding 0.07862075401269131 promising 0.06504292646509892 cell 0.0631765584173199 activity 0.058883911907428144 stability 0.03910041060097051 interaction 0.037467338559163864 synthesized 0.03270810003732736 performance 0.02902202314296379 experimental 0.02892870474057484 protein 0.024262784621127288 development 0.023142963792459875 effective 0.021883165360209032 mechanism 0.021416573348264276 including 0.020530048525569243 synthesis 0.016330720418066443 design 0.0046192609182530795 chemical 0.0
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