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Application

Discovery Studio 1.0 Materials Studio 0.9978201194897465 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06691879399096544 Amorphous Cell 0.277340056728648 Blends 0.0025212732429877086 CASTEP 0.38386385124487865 CDOCKER 0.16577371572644184 CHARMm 0.26021640928668976 COMPASS 0.3578106944006723 COMPASS III 0.0857232902615821 COSMObase 0.003781909864481563 COSMOconf 0.00441222817522849 COSMOmic 1.0505305179115453E-4 COSMOperm 0.0012606366214938543 COSMOplex 2.1010610358230907E-4 COSMOquick 0.0014707427250761635 COSMOtherm 0.06313688412648387 Cantera 0.0 Catalyst 0.1203907973526631 Classical Simulations 1.0 Conformers 7.353713625380818E-4 Crystallization 0.07332703015022586 DFTB Plus 0.0057779178485134995 DMol3 0.1726021640928669 DPD 0.002731379346570018 Discover 0.003361697657316945 Forcite 0.5331442378401092 GULP 0.02321672444584515 Kinetix 2.1010610358230907E-4 LUDI 0.003781909864481563 LibDock 0.0709108099590293 LigandFit 0.0049374934341842635 MCSS 5.252652589557726E-4 MODELER 0.19466330496900935 MesoDyn 0.0010505305179115453 Mesocite 0.003781909864481563 Mesoscale 0.00672339531463389 Modules 0.0 Morphology 0.0173337535455405 ONETEP 0.0010505305179115453 Polymorph 0.001996007984031936 QMERA 1.0505305179115453E-4 QSAR 0.0011555835697027 Quantum Mechanics 0.5450152326925097 Reflex 0.0533669503099065 Reflex Plus 9.454774661203908E-4 Semi-empirical 0.007563819728963126 Sorption 0.05620338270826768 Synthia 0.0014707427250761635 TURBOMOLE 5.252652589557726E-4 VAMP 0.0014707427250761635 Visualization 0.8276079420107154 X-Cell 0.001365689673285009 ZDOCK 0.028784536190776342

Year

2022 0.05988981695397192 2023 0.3279722765239026 2024 0.5943664474853385 2025 1.0 2026 0.3776435045317221 2027 0.0

Keywords

target 1.0 potential 0.28637285635257237 docking 0.22565922920892495 visualization 0.20615895260925687 analysis 0.19726166328600406 between 0.15595611285266459 novel 0.10427807486631016 energy 0.08791259450488659 binding 0.07449751060298727 cell 0.0644477226627328 promising 0.06347962382445141 activity 0.05628803245436106 stability 0.04042965148441822 interaction 0.03711045546745344 synthesized 0.031901161718605936 experimental 0.030886962935644476 performance 0.030656463212244144 development 0.02245067305919233 effective 0.02175917388899133 mechanism 0.021574774110271068 protein 0.021067674718790338 including 0.019684676378388347 synthesis 0.014475382629540845 design 0.004195094965886041 chemical 0.0
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