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Application

Discovery Studio 0.8556384041817203 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06842875052235688 Amorphous Cell 0.2901170079398245 Blends 0.0025073129962390303 CASTEP 0.40869201838696195 CDOCKER 0.15294609277058085 CHARMm 0.23453823652319264 COMPASS 0.37599247806101127 COMPASS III 0.08503969912244046 COSMObase 0.003238612620142081 COSMOconf 0.004387797743418303 COSMOmic 2.089427496865859E-4 COSMOperm 0.0012536564981195152 COSMOplex 3.134141245298788E-4 COSMOquick 0.0015670706226493941 COSMOtherm 0.06602590890096113 Cantera 0.0 Catalyst 0.1063518595904722 Classical Simulations 1.0 Conformers 6.268282490597576E-4 Crystallization 0.07657751776013372 DFTB Plus 0.006163811115754284 DMol3 0.18386961972419558 DPD 0.003029669870455495 Discover 0.004178854993731718 Forcite 0.5542206435436691 GULP 0.02319264521521103 Kinetix 2.089427496865859E-4 LUDI 0.003969912244045131 LibDock 0.06393648140409527 LigandFit 0.005014625992478061 MCSS 4.178854993731718E-4 MODELER 0.1834517342248224 MesoDyn 0.0010447137484329294 Mesocite 0.003865440869201839 Mesoscale 0.006999582114500627 Modules 0.0 Morphology 0.017969076473046384 ONETEP 0.0012536564981195152 Polymorph 0.002089427496865859 QMERA 2.089427496865859E-4 QSAR 0.0014625992478061011 Quantum Mechanics 0.5810697868783953 Reflex 0.055892185541161724 Reflex Plus 9.402423735896364E-4 Semi-empirical 0.007939824488090262 Sorption 0.055787714166318426 Synthia 0.0013581278729628081 TURBOMOLE 5.223568742164647E-4 VAMP 0.0013581278729628081 Visualization 0.7459256163811115 X-Cell 0.0012536564981195152 ZDOCK 0.027162557459256165

Year

2021 0.0026150121065375304 2022 0.14692493946731236 2023 0.2122033898305085 2024 0.7482808716707022 2025 1.0 2026 0.41152542372881357 2027 0.0

Keywords

target 1.0 potential 0.2674593476830529 docking 0.19061941911833818 analysis 0.1850737851301814 visualization 0.1748754582197575 between 0.15762759657862582 energy 0.09540370335557853 novel 0.09441676849327944 cell 0.06626562646865307 binding 0.06015602970203966 promising 0.058229156875646206 activity 0.042908168060907984 stability 0.037738509258388946 performance 0.03538866434815302 experimental 0.031628912491775546 interaction 0.02833912961744525 synthesized 0.02584829401259517 effective 0.02016166932982423 mechanism 0.01955070965316289 development 0.014240060156029702 including 0.014240060156029702 synthesis 0.0055456339881567816 protein 0.0030078014851019834 design 0.0010809286587085253 chemical 0.0
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