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Application

Discovery Studio 1.0 Materials Studio 0.9950468540829986 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0675687627133634 Amorphous Cell 0.27938445210931284 Blends 0.002476342088971434 CASTEP 0.39435747766870083 CDOCKER 0.1710444857168126 CHARMm 0.2584239851419475 COMPASS 0.36517201733439464 COMPASS III 0.07915450605819403 COSMObase 0.003272309188997966 COSMOconf 0.0038029539223489875 COSMOmic 1.7688157778367384E-4 COSMOperm 0.0013266118333775537 COSMOplex 2.653223666755107E-4 COSMOquick 0.001238171044485717 COSMOtherm 0.0625276377465287 Cantera 0.0 Catalyst 0.12753161758202883 Classical Simulations 1.0 Conformers 7.959671000265323E-4 Crystallization 0.07402494030246749 DFTB Plus 0.0057486512779694 DMol3 0.1784735119837269 DPD 0.003095427611214292 Discover 0.0038029539223489875 Forcite 0.5345361280622624 GULP 0.02582471035641638 Kinetix 2.653223666755107E-4 LUDI 0.004687361811267356 LibDock 0.07101795348014504 LigandFit 0.006190855222428584 MCSS 8.844078889183692E-4 MODELER 0.17794286725037586 MesoDyn 0.0014150526222693907 Mesocite 0.004156717077916335 Mesoscale 0.007605907844697975 Modules 0.0 Morphology 0.01751127620058371 ONETEP 9.728486778102061E-4 Polymorph 0.0018572565667285751 QMERA 2.653223666755107E-4 QSAR 9.728486778102061E-4 Quantum Mechanics 0.5621296541965154 Reflex 0.05421420359069603 Reflex Plus 7.959671000265323E-4 Semi-empirical 0.007694348633589812 Sorption 0.0543910851684797 Synthia 0.0015034934111612275 TURBOMOLE 5.306447333510214E-4 VAMP 0.0015034934111612275 Visualization 0.8501813036172282 X-Cell 0.001238171044485717 ZDOCK 0.029892986645440878

Year

2021 0.006486676016830294 2022 0.23194249649368864 2023 0.3763148667601683 2024 0.810922159887798 2025 1.0 2026 0.37263323983169705 2027 0.0

Keywords

target 1.0 potential 0.27294584589550813 docking 0.2187154142655421 visualization 0.2078769606533603 analysis 0.18665801625768041 between 0.15200549555394421 novel 0.10094264015570736 energy 0.08445597832309278 binding 0.07136587413654925 cell 0.06201579971758959 activity 0.051062855398236844 promising 0.05102469182917987 interaction 0.038049078349807273 stability 0.03297332366522917 synthesized 0.029882074571613938 experimental 0.02812655039499294 performance 0.02278365072701599 protein 0.020035873754913558 effective 0.0196160744952868 mechanism 0.01870014883791932 development 0.017936877456779757 including 0.014120520551081938 synthesis 0.013242758462771438 design 0.0016791970385070412 chemical 0.0
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