Sign-In
Cart
Computer-Aided Drug Design
Paperback
Publisher: Notion Press
Published: Mar 17 2026
Pages: 396
Weight: 1.16
Height: 0.81 Width: 6.00 Depth: 9.00
Language: English
Computer-aided drug design has transformed the way modern medicines are discovered. By integrating chemistry, biology and computational science, it enables researchers to understand molecular interactions, predict biological activity and design safer, more effective therapeutic agents. Computer Aided Drug Design presents these concepts in a clear, structured and student-friendly manner, making complex computational principles accessible to pharmacy learners.
The book systematically covers the core foundations of the field, including quantitative structure-activity relationships (QSAR), molecular modeling, molecular mechanics and force fields, docking and scoring functions, pharmacophore modeling, virtual screening, drug-likeness and ADMET prediction, chemoinformatics databases, energy minimization, conformational analysis and the role of quantum mechanics in drug design.
A distinctive strength of this text is its emphasis on high-quality scientific illustrations and carefully designed infographics that visually explain complex concepts. Each chapter follows an exam-oriented and concept-driven approach, enabling students to understand the subject deeply while also preparing effectively for university examinations.
Designed for B.Pharm, M.Pharm, M.Sc and research students, this book serves as a reliable guide for mastering the principles and applications of computer-aided drug design in modern pharmaceutical research.
1 different editions
Also available
Also from
Dr Muni Sireesha
Also in
General Reference
The Science Magpie: Fascinating Facts, Stories, Poems, Diagrams and Jokes Plucked from Science
Flynn, Simon
Paperback
Peculiar Questions and Practical Answers: A Little Book of Whimsy and Wisdom from the Files of the New York Public Library
New York Public Library
Hardcover
Lost in Space: 5,000 Facts for Navigating the Universe
Walker, Lindsey Nyx
Tyson, Neil Degrasse
Hardcover
The New Dark Ages: The Death of Reading and the Dawn of the Post-Literate Society
Marriott, James
Hardcover
The Book of Unusual Knowledge: Big Book of Fascinating Facts & Information Hardcover Gift for Trivia Buffs, Curious Minds, Adults, Dad & Knowledge See
Publications International Ltd
Hardcover
Canning & Preserving: The Techniques, Equipment, and Recipes to Get Started
Harmeling, Michele
Paperback
Floriography: An Illustrated Guide to the Victorian Language of Flowers Volume 1
Roux, Jessica
Hardcover
The New Worst-Case Scenario Survival Handbook: Expert Advice for Extreme Situations
Borgenicht, David
Piven, Joshua
Hardcover
Mushrooms of the Upper Midwest: A Simple Guide to Common Mushrooms
Yerich, Kathy
Marrone, Teresa
Paperback
White Elephant Gifts for Adult: 500 Serial Killers Encyclopedia Facts and Figures
Murdle, K.
Paperback
The Bookshop: A History of Bookselling from the Dawn of Print to the Twenty-First Century
Pettegree, Andrew
Hardcover
Cribsheet: A Data-Driven Guide to Better, More Relaxed Parenting, from Birth to Preschool
Oster, Emily
Paperback
The Modern Guide to Querying Literary Agents: From Rejection to Representation in 8 Steps
McDonald, Patrick
Matesic, Alyssa
Paperback
Magnifica Humanitas: On Safeguarding the Human Person in the Time of Artificial Intelligence
Leo XIV, Pope
Paperback
Within the House of Murdaugh: Amid a Unique Friendship, Blanca and Maggie
Turrubiate-Simpson, Blanca
Weaver, Mary Frances
Paperback
Chase's Calendar of Events 2027: The Ultimate Go-To Guide for Special Days, Weeks and Months
Chase's, Editors Of
Paperback
Save the Cat! Writes a Novel: The Last Book on Novel Writing You'll Ever Need
Brody, Jessica
Paperback
American Sign Language Made Easy for Beginners: A Visual Guide with ASL Signs, Lessons, and Quizzes
Belmontes-Merrell, Travis
Paperback
The Trusted Advisor: 20th Anniversary Edition
Galford, Robert
Green, Charles
Maister, David H.
Paperback
The Writing Revolution 2.0: A Guide to Advancing Thinking Through Writing in All Subjects and Grades
Wexler, Natalie
Hochman, Judith C.
Paperback
Take It from Me: An Agent's Guide to Building a Nonfiction Writing Career from Scratch
Habib, Alia Hanna
Hardcover
The Writing Rope: A Framework for Explicit Writing Instruction in All Subjects
Sedita, Joan
Paperback
Everything I Need to Know I Learned from Dolly Parton: Country Wisdom for Life's Little Challenges
Sharaf, Juliana
Hardcover
Robert's Rules of Order Newly Revised, 12th Edition
Balch, Thomas J.
Robert, Henry M., III
Honemann, Daniel H.
Paperback
French Short Stories: Thirty French Short Stories for Beginners to Improve your French Vocabulary
Moreau, Dylane
Paperback
Seberson Method: New Sat(r) Vocabulary Workbook: Over 700 High-Frequency Words to Master
Seberson, Katya
Paperback
Freeing the Natural Voice: Imagery and Art in the Practice of Voice and Language (Revised & Expanded)
Linklater, Kristin
Paperback
Read These Banned Books: A Journal and 52-Week Reading Challenge from the American Library Association
American Library Association (ALA)
Paperback
Next Steps in Literacy Instruction: Connecting Assessments to Effective Interventions
Glaser, Deborah, Ed D.
Smartt, Susan, PH. D.
Paperback
The Public Domain: Find and Use Free Content for Your Website, Book, App, Music, Video, Art, and More
Secor, Glen
Paperback
The New Lifetime Reading Plan: The Classical Guide to World Literature, Revised and Expanded
Fadiman, Clifton
Major, John S.
Paperback
The Preparation: How To Become Competent, Confident, and Dangerous
Smith, Matt
Smith, Maxim
Casey, Doug
Hardcover
The Vocabulary Builder Workbook: Simple Lessons and Activities to Teach Yourself Over 1,400 Must-Know Words
Magoosh
Lele, Chris
Paperback
The Essentials of Adolescent Literacy: Integrating Evidence-Based Reading and Writing Instruction in Grades 5-12
Sedita, Joan
Paperback
Effective Phrases for Performance Appraisals: A Guide to Successful Evaluations
Neal Jr, James E.
Paperback
The Reading Strategies Book 2.0: Your Research-Based Guide to Developing Skilled Readers
Serravallo, Jennifer
Paperback
The Naked Roommate: And 107 Other Issues You Might Run Into in College (Revised and Updated)
Cohen, Harlan
Paperback
True Facts That Sound Like Bull$#*t: 500 Insane-But-True Facts That Will Shock and Impress Your Friends 1
Carley, Shane
Paperback
5 Steps to a 5: AP English Language and Composition 2027: Practice AP Tests + AP Content Review + Digital Exams
Murphy, Barbara
Paperback
Writing Fiction, Tenth Edition: A Guide to Narrative Craft
Stuckey-French, Ned
Burroway, Janet
Stuckey-French, Elizabeth
Paperback
Elledge's Nontrivial Trivia: The Seriously Enlightening Stories Behind Supposedly Simple Facts
Elledge, Jonn
Paperback
The Science of Storytelling: Why Stories Make Us Human and How to Tell Them Better
Storr, Will
Paperback
Stuff Every Adult Should Know: A Pocket-Sized Guide to Grown-Up Know-How, from Taxes to Small Talk
Cohen, Brett
Favreau, Alyssa
Kalb, Alanna
Hardcover
Vanishing Culture: A Report on Our Fragile Cultural Record
Ziskina, Juliya
Freeland, Chris
Messarra, Luca
Paperback
The Essentials: The Art of Interior Design: A Guide to Furnishing, Decorating, and Styling Your Home
Flemming, Caitlin
Goebel, Julie
Hardcover
The New American Ephemeris for the 21st Century 2000-2100 at Midnight, Michelsen Memorial Edition
Michelsen, Neil F.
Paperback
Self-Editing for Fiction Writers, Second Edition: How to Edit Yourself Into Print
Browne, Renni
King, Dave
Paperback
180 Days(r) Reading for Fifth Grade, 2nd Edition: Practice, Assess, Diagnose
Kopp, Kathy
Levsey, Dylan
Kopp, Kathleen N.
Paperback
Totally Awesome Book of Useless Information: A Delightfully Absurd Collection of Unusual Knowledge for Adults and Teens
Style, Life Daily
Paperback
The Book For Men Who Have Everything: Unusual Knowledge and Boredom Busters for Intelligent Men
Iq Street
Paperback
The Best Punctuation Book, Period (Revised Edition): A Comprehensive Guide for Every Writer, Editor, Student, and Businessperson
Casagrande, June
Paperback
7 Keys to Comprehension: How to Help Your Kids Read It and Get It!
Hutchins, Chryse
Zimmermann, Susan
Paperback
Spelling High School Grades 9-10: Vocabulary and Writing Practice with Interactive Activities
Attard, Natasha
Paperback
How to Survive Being a Grandparent: A Hilarious Guide for Grandmas and Grandads
Freeman, Kate
Hardcover