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Application

Discovery Studio 1.0 Materials Studio 0.953533542507097 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05988967691095351 Amorphous Cell 0.274822695035461 Blends 0.002364066193853428 CASTEP 0.35894405043341215 CDOCKER 0.17631993695823484 CHARMm 0.2693065405831363 COMPASS 0.34574468085106386 COMPASS III 0.10027580772261624 COSMObase 0.004334121355397951 COSMOconf 0.00512214342001576 COSMOmic 1.9700551615445234E-4 COSMOperm 0.0013790386130811663 COSMOplex 1.9700551615445234E-4 COSMOquick 9.850275807722615E-4 COSMOtherm 0.06304176516942474 Catalyst 0.10756501182033097 Classical Simulations 1.0 Conformers 5.91016548463357E-4 Crystallization 0.07131599684791175 DFTB Plus 0.0065011820330969266 DMol3 0.16016548463356975 DPD 0.00256107171000788 Discover 0.0031520882584712374 Forcite 0.5281717888100866 GULP 0.021079590228526398 Kinetix 3.940110323089047E-4 LUDI 0.002364066193853428 LibDock 0.07249802994483845 LigandFit 0.004531126871552403 MODELER 0.225177304964539 MesoDyn 3.940110323089047E-4 Mesocite 0.0027580772261623326 Mesoscale 0.005516154452324665 Modules 0.0 Morphology 0.0169424743892829 ONETEP 0.001182033096926714 Polymorph 0.002364066193853428 QMERA 0.0 QSAR 3.940110323089047E-4 Quantum Mechanics 0.5090622537431048 Reflex 0.05102442868400315 Reflex Plus 0.0013790386130811663 Semi-empirical 0.007486209613869189 Sorption 0.06107171000788022 Synthia 0.001970055161544523 TURBOMOLE 1.9700551615445234E-4 VAMP 5.91016548463357E-4 Visualization 0.8112687155240347 X-Cell 9.850275807722615E-4 ZDOCK 0.028565799842395587

Year

2022 0.0 2023 0.19200115925228228 2024 0.3992175047094624 2025 1.0 2026 0.44602231560643385 2027 0.001304158817562672

Keywords

target 1.0 potential 0.3014400565420974 docking 0.23182259916953796 analysis 0.20894071914480078 visualization 0.20090113967664988 between 0.150278293135436 novel 0.1031893276791236 energy 0.08516653414612599 binding 0.07703860765085255 promising 0.07686191359660748 cell 0.06290308331124658 activity 0.06016432547044792 stability 0.03869599787967135 performance 0.032865094089583886 synthesized 0.03039137733015284 interaction 0.030214683275907765 development 0.024560473540065377 including 0.023677003268840004 experimental 0.021733368672144183 effective 0.021114939482286422 mechanism 0.019966428129693434 protein 0.014842300556586271 synthesis 0.009364784874988957 enhanced 0.0023853697323085077 design 0.0
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